
 AC1NKC6O

 64 66  0  0  0  0  0  0  0  0999 V2000
    1.4767    4.4555   -0.8614 C   0  0  0  0  0
    1.4107    3.7692   -2.2198 C   0  0  0  0  0
    2.6577    2.9659   -2.4988 C   0  0  0  0  0
    3.6411    3.5587   -3.1975 C   0  0  0  0  0
    4.9231    2.9278   -3.5171 C   0  0  0  0  0
    5.7825    3.5300   -4.1490 O   0  0  0  0  0
    5.1036    1.6452   -3.0502 O   0  0  0  0  0
    4.0858    0.9683   -2.3440 C   0  0  0  0  0
    2.8479    1.5633   -2.0434 C   0  0  0  0  0
    1.9187    0.7628   -1.3349 C   0  0  0  0  0
    2.2452   -0.5656   -0.9938 C   0  0  0  0  0
    3.4840   -1.1285   -1.3239 C   0  0  0  0  0
    4.4157   -0.3420   -1.9884 C   0  0  0  0  0
    3.8038   -2.5439   -0.9460 C   0  0  0  0  0
    0.6750    1.2769   -1.0662 O   0  0  0  0  0
   -0.0115    0.8426    0.1062 C   0  0  0  0  0
   -0.9082    2.0092    0.5334 C   0  0  0  0  0
   -0.9074   -0.4147   -0.0492 C   0  0  0  0  0
   -1.1031   -0.9886   -1.1155 O   0  0  0  0  0
   -1.4472   -0.8557    1.1492 N   0  0  0  0  0
   -2.2628   -2.0659    1.2571 C   0  0  0  0  0
   -3.1614   -1.9617    2.4912 C   0  0  0  0  0
   -3.9730   -3.2409    2.7649 C   0  0  0  0  0
   -3.1284   -4.4473    2.7326 N   0  0  0  0  0
   -2.1685   -4.5953    1.6230 C   0  0  0  0  0
   -1.3687   -3.3017    1.3767 C   0  0  0  0  0
   -2.8520   -5.0901    0.3364 C   0  0  0  0  0
   -1.1763   -5.7020    2.0511 C   0  0  0  0  0
   -5.1784   -3.3588    1.8164 C   0  0  0  0  0
   -4.5465   -3.1461    4.1991 C   0  0  0  0  0
    0.5386    4.9815   -0.6576 H   0  0  0  0  0
    2.2847    5.1952   -0.8363 H   0  0  0  0  0
    1.6561    3.7429   -0.0513 H   0  0  0  0  0
    1.2953    4.5535   -2.9810 H   0  0  0  0  0
    0.5022    3.1716   -2.3242 H   0  0  0  0  0
    3.5520    4.5787   -3.5561 H   0  0  0  0  0
    1.5219   -1.2092   -0.5030 H   0  0  0  0  0
    5.3914   -0.7406   -2.2561 H   0  0  0  0  0
    4.6156   -2.9443   -1.5627 H   0  0  0  0  0
    2.9326   -3.1898   -1.0981 H   0  0  0  0  0
    4.1069   -2.5926    0.1042 H   0  0  0  0  0
    0.7058    0.6568    0.9175 H   0  0  0  0  0
   -1.5647    2.3125   -0.2904 H   0  0  0  0  0
   -0.3043    2.8819    0.7965 H   0  0  0  0  0
   -1.5352    1.7672    1.3966 H   0  0  0  0  0
   -1.1067   -0.4449    2.0093 H   0  0  0  0  0
   -2.8730   -2.1318    0.3498 H   0  0  0  0  0
   -3.8354   -1.1012    2.3821 H   0  0  0  0  0
   -2.5315   -1.7355    3.3641 H   0  0  0  0  0
   -2.6178   -4.5131    3.6148 H   0  0  0  0  0
   -0.6612   -3.1423    2.2034 H   0  0  0  0  0
   -0.7516   -3.4054    0.4743 H   0  0  0  0  0
   -3.4281   -4.3147   -0.1701 H   0  0  0  0  0
   -3.5237   -5.9319    0.5425 H   0  0  0  0  0
   -2.1084   -5.4412   -0.3893 H   0  0  0  0  0
   -0.6412   -5.4327    2.9698 H   0  0  0  0  0
   -0.4219   -5.8778    1.2753 H   0  0  0  0  0
   -1.6920   -6.6526    2.2338 H   0  0  0  0  0
   -4.9126   -3.2321    0.7662 H   0  0  0  0  0
   -5.9254   -2.5868    2.0381 H   0  0  0  0  0
   -5.6766   -4.3293    1.9270 H   0  0  0  0  0
   -3.7501   -3.0621    4.9487 H   0  0  0  0  0
   -5.1468   -4.0288    4.4500 H   0  0  0  0  0
   -5.1896   -2.2649    4.3096 H   0  0  0  0  0
  1  2  1  0  0  0
  1 31  1  0  0  0
  1 32  1  0  0  0
  1 33  1  0  0  0
  2  3  1  0  0  0
  2 34  1  0  0  0
  2 35  1  0  0  0
  3  4  2  0  0  0
  3  9  1  0  0  0
  4  5  1  0  0  0
  4 36  1  0  0  0
  5  7  1  0  0  0
  5  6  2  0  0  0
  7  8  1  0  0  0
  8 13  1  0  0  0
  8  9  2  0  0  0
  9 10  1  0  0  0
 10 11  2  0  0  0
 10 15  1  0  0  0
 11 12  1  0  0  0
 11 37  1  0  0  0
 12 13  2  0  0  0
 12 14  1  0  0  0
 13 38  1  0  0  0
 14 39  1  0  0  0
 14 40  1  0  0  0
 14 41  1  0  0  0
 15 16  1  0  0  0
 16 18  1  0  0  0
 16 17  1  0  0  0
 16 42  1  0  0  0
 17 43  1  0  0  0
 17 44  1  0  0  0
 17 45  1  0  0  0
 18 20  1  0  0  0
 18 19  2  0  0  0
 20 21  1  0  0  0
 20 46  1  0  0  0
 21 26  1  0  0  0
 21 22  1  0  0  0
 21 47  1  0  0  0
 22 23  1  0  0  0
 22 48  1  0  0  0
 22 49  1  0  0  0
 23 24  1  0  0  0
 23 30  1  0  0  0
 23 29  1  0  0  0
 24 25  1  0  0  0
 24 50  1  0  0  0
 25 26  1  0  0  0
 25 28  1  0  0  0
 25 27  1  0  0  0
 26 51  1  0  0  0
 26 52  1  0  0  0
 27 53  1  0  0  0
 27 54  1  0  0  0
 27 55  1  0  0  0
 28 56  1  0  0  0
 28 57  1  0  0  0
 28 58  1  0  0  0
 29 59  1  0  0  0
 29 60  1  0  0  0
 29 61  1  0  0  0
 30 62  1  0  0  0
 30 63  1  0  0  0
 30 64  1  0  0  0
M  END

>  <Chemical Name>
AC1NKC6O

>  <PubChem CID>
4911035

>  <Formula>
C24H34N2O4

>  <Molecular Weight>
414.546000

>  <IUPAC Name>
2-(4-ethyl-7-methyl-2-oxochromen-5-yl)oxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

>  <XlogP>
3.7

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)NC3CC(NC(C3)(C)C)(C)C

>  <Isomeric SMILES>
CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)NC3CC(NC(C3)(C)C)(C)C

>  <InChI Std. ID>
InChI=1S/C24H34N2O4/c1-8-16-11-20(27)30-19-10-14(2)9-18(21(16)19)29-15(3)22(28)25-17-12-23(4,5)26-24(6,7)13-17/h9-11,15,17,26H,8,12-13H2,1-7H3,(H,25,28)

>  <InChI Key>
AABAXVYXHFJILS-UHFFFAOYSA-N

