
 4-ethoxy-N-(quinolin-8-ylmethylideneamino)benzamide

 41 43  0  0  0  0  0  0  0  0999 V2000
    5.9159    8.4654   -5.3163 C   0  0  0  0  0
    6.7152    7.6890   -4.2843 C   0  0  0  0  0
    6.8342    6.3439   -4.7468 O   0  0  0  0  0
    7.4278    5.4568   -3.8922 C   0  0  0  0  0
    7.1372    4.1139   -4.1473 C   0  0  0  0  0
    7.6869    3.1020   -3.3558 C   0  0  0  0  0
    8.5567    3.4320   -2.3105 C   0  0  0  0  0
    8.8460    4.7771   -2.0517 C   0  0  0  0  0
    8.2875    5.7867   -2.8439 C   0  0  0  0  0
    9.1725    2.3892   -1.4450 C   0  0  0  0  0
    9.3932    2.6434   -0.2654 O   0  0  0  0  0
    9.4864    1.2055   -2.0948 N   0  0  0  0  0
   10.0574    0.1758   -1.4066 N   0  0  0  0  0
   10.4766   -0.8081   -2.1393 C   0  0  0  0  0
   11.1253   -1.9979   -1.5534 C   0  0  0  0  0
   11.1008   -2.1783   -0.1618 C   0  0  0  0  0
   11.7149   -3.2897    0.4019 C   0  0  0  0  0
   12.3575   -4.2086   -0.4234 C   0  0  0  0  0
   12.3861   -4.0222   -1.8174 C   0  0  0  0  0
   11.7573   -2.9054   -2.4121 C   0  0  0  0  0
   11.7824   -2.7238   -3.7566 N   0  0  0  0  0
   12.4301   -3.6268   -4.5225 C   0  0  0  0  0
   13.0738   -4.7380   -4.0225 C   0  0  0  0  0
   13.0464   -4.9384   -2.6480 C   0  0  0  0  0
    5.7543    9.4967   -4.9897 H   0  0  0  0  0
    4.9446    7.9918   -5.4927 H   0  0  0  0  0
    6.4427    8.4791   -6.2764 H   0  0  0  0  0
    6.1882    7.7134   -3.3236 H   0  0  0  0  0
    7.7029    8.1516   -4.1844 H   0  0  0  0  0
    6.4601    3.8572   -4.9587 H   0  0  0  0  0
    7.4025    2.0721   -3.5505 H   0  0  0  0  0
    9.5155    5.0407   -1.2342 H   0  0  0  0  0
    8.5535    6.8151   -2.6231 H   0  0  0  0  0
    9.4134    1.1366   -3.1031 H   0  0  0  0  0
   10.3727   -0.7825   -3.2398 H   0  0  0  0  0
   10.6035   -1.4525    0.4798 H   0  0  0  0  0
   11.6977   -3.4352    1.4791 H   0  0  0  0  0
   12.8422   -5.0714    0.0289 H   0  0  0  0  0
   12.4209   -3.4194   -5.5904 H   0  0  0  0  0
   13.5843   -5.4312   -4.6808 H   0  0  0  0  0
   13.5475   -5.8073   -2.2291 H   0  0  0  0  0
  1  2  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  2  3  1  0  0  0
  2 28  1  0  0  0
  2 29  1  0  0  0
  3  4  1  0  0  0
  4  5  2  0  0  0
  4  9  1  0  0  0
  5  6  1  0  0  0
  5 30  1  0  0  0
  6  7  2  0  0  0
  6 31  1  0  0  0
  7  8  1  0  0  0
  7 10  1  0  0  0
  8  9  2  0  0  0
  8 32  1  0  0  0
  9 33  1  0  0  0
 10 12  1  0  0  0
 10 11  2  0  0  0
 12 13  1  0  0  0
 12 34  1  0  0  0
 13 14  2  0  0  0
 14 15  1  0  0  0
 14 35  1  0  0  0
 15 16  2  0  0  0
 15 20  1  0  0  0
 16 17  1  0  0  0
 16 36  1  0  0  0
 17 18  2  0  0  0
 17 37  1  0  0  0
 18 19  1  0  0  0
 18 38  1  0  0  0
 19 24  1  0  0  0
 19 20  2  0  0  0
 20 21  1  0  0  0
 21 22  2  0  0  0
 22 23  1  0  0  0
 22 39  1  0  0  0
 23 24  2  0  0  0
 23 40  1  0  0  0
 24 41  1  0  0  0
M  END

>  <Chemical Name>
4-ethoxy-N-(quinolin-8-ylmethylideneamino)benzamide

>  <PubChem CID>
869691

>  <Formula>
C19H17N3O2

>  <Molecular Weight>
319.364000

>  <IUPAC Name>
4-ethoxy-N-(quinolin-8-ylmethylideneamino)benzamide

>  <XlogP>
3.4

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCOC1=CC=C(C=C1)C(=O)NN=CC2=CC=CC3=C2N=CC=C3

>  <Isomeric SMILES>
CCOC1=CC=C(C=C1)C(=O)NN=CC2=CC=CC3=C2N=CC=C3

>  <InChI Std. ID>
InChI=1S/C19H17N3O2/c1-2-24-17-10-8-15(9-11-17)19(23)22-21-13-16-6-3-5-14-7-4-12-20-18(14)16/h3-13H,2H2,1H3,(H,22,23)

>  <InChI Key>
AYZSUTXQDSXZBC-UHFFFAOYSA-N

