
 920317-82-4

 44 45  0  0  0  0  0  0  0  0999 V2000
    1.9320    1.3445    2.7826 C   0  0  0  0  0
    2.5378    1.3917    1.4056 C   0  0  0  0  0
    1.8987    1.7728    0.4312 O   0  0  0  0  0
    3.8449    0.9674    1.3472 N   0  0  0  0  0
    4.6155    1.0240    0.1237 C   0  0  0  0  0
    5.2233    2.3913    0.0470 C   0  0  0  0  0
    6.5288    2.7386    0.0046 C   0  0  0  0  0
    7.5572    1.6747   -0.0507 C   0  0  0  0  0
    7.9726    1.1633   -1.2906 C   0  0  0  0  0
    8.9684    0.1882   -1.3519 C   0  0  0  0  0
    9.5126   -0.3152   -0.1691 C   0  0  0  0  0
    9.1019    0.1842    1.0678 C   0  0  0  0  0
    8.1321    1.1851    1.1275 C   0  0  0  0  0
    9.4611   -0.3606   -2.5044 O   0  0  0  0  0
    9.4215    0.4873   -3.6484 C   0  0  0  0  0
    6.8677    4.1908   -0.0179 C   0  0  0  0  0
    7.8845    4.6714   -0.8562 C   0  0  0  0  0
    8.2463    6.0226   -0.8590 C   0  0  0  0  0
    7.5686    6.9191   -0.0350 C   0  0  0  0  0
    6.5590    6.4593    0.8106 C   0  0  0  0  0
    6.2204    5.1049    0.8279 C   0  0  0  0  0
    9.2559    6.3478   -1.7239 O   0  0  0  0  0
    9.9608    7.5484   -1.4312 C   0  0  0  0  0
    2.6949    1.2360    3.5582 H   0  0  0  0  0
    1.2396    0.5011    2.8408 H   0  0  0  0  0
    1.3916    2.2777    2.9657 H   0  0  0  0  0
    4.3432    0.7621    2.2017 H   0  0  0  0  0
    3.9635    0.8539   -0.7386 H   0  0  0  0  0
    5.3501    0.2167    0.1687 H   0  0  0  0  0
    4.4697    3.1788    0.0069 H   0  0  0  0  0
    7.5061    1.5443   -2.1941 H   0  0  0  0  0
   10.2759   -1.0883   -0.2138 H   0  0  0  0  0
    9.5461   -0.2009    1.9821 H   0  0  0  0  0
    7.8284    1.5821    2.0927 H   0  0  0  0  0
   10.0166    0.0136   -4.4359 H   0  0  0  0  0
    9.8672    1.4662   -3.4362 H   0  0  0  0  0
    8.3993    0.5941   -4.0257 H   0  0  0  0  0
    8.4190    3.9963   -1.5191 H   0  0  0  0  0
    7.7979    7.9793   -0.0347 H   0  0  0  0  0
    6.0337    7.1562    1.4587 H   0  0  0  0  0
    5.4445    4.7714    1.5132 H   0  0  0  0  0
   10.8412    7.5850   -2.0802 H   0  0  0  0  0
   10.3115    7.5622   -0.3931 H   0  0  0  0  0
    9.3476    8.4279   -1.6520 H   0  0  0  0  0
  1  2  1  0  0  0
  1 24  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  4  5  1  0  0  0
  4 27  1  0  0  0
  5  6  1  0  0  0
  5 28  1  0  0  0
  5 29  1  0  0  0
  6  7  2  0  0  0
  6 30  1  0  0  0
  7 16  1  0  0  0
  7  8  1  0  0  0
  8  9  2  0  0  0
  8 13  1  0  0  0
  9 10  1  0  0  0
  9 31  1  0  0  0
 10 11  2  0  0  0
 10 14  1  0  0  0
 11 12  1  0  0  0
 11 32  1  0  0  0
 12 13  2  0  0  0
 12 33  1  0  0  0
 13 34  1  0  0  0
 14 15  1  0  0  0
 15 35  1  0  0  0
 15 36  1  0  0  0
 15 37  1  0  0  0
 16 17  2  0  0  0
 16 21  1  0  0  0
 17 18  1  0  0  0
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 18 19  2  0  0  0
 18 22  1  0  0  0
 19 20  1  0  0  0
 19 39  1  0  0  0
 20 21  2  0  0  0
 20 40  1  0  0  0
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 22 23  1  0  0  0
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 23 43  1  0  0  0
 23 44  1  0  0  0
M  END

>  <Chemical Name>
920317-82-4

>  <PubChem CID>
16094586

>  <Formula>
C19H21NO3

>  <Molecular Weight>
311.381000

>  <IUPAC Name>
N-[3,3-bis(3-methoxyphenyl)prop-2-enyl]acetamide

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(=O)NCC=C(C1=CC(=CC=C1)OC)C2=CC(=CC=C2)OC

>  <Isomeric SMILES>
CC(=O)NCC=C(C1=CC(=CC=C1)OC)C2=CC(=CC=C2)OC

>  <InChI Std. ID>
InChI=1S/C19H21NO3/c1-14(21)20-11-10-19(15-6-4-8-17(12-15)22-2)16-7-5-9-18(13-16)23-3/h4-10,12-13H,11H2,1-3H3,(H,20,21)

>  <InChI Key>
BZHIFCBOSAEOKV-UHFFFAOYSA-N

