
 SCHEMBL3309293

 49 52  0  0  0  0  0  0  0  0999 V2000
    7.4149    3.9851    1.1740 C   0  0  0  0  0
    6.6145    3.1126    2.1249 C   0  0  0  0  0
    5.3342    2.7938    1.5614 O   0  0  0  0  0
    5.3254    1.6277    0.8397 C   0  0  0  0  0
    4.8852    1.6347   -0.4914 C   0  0  0  0  0
    4.9379    0.4583   -1.2890 C   0  0  0  0  0
    4.6400    0.4233   -2.6740 C   0  0  0  0  0
    4.6682   -0.7675   -3.3989 C   0  0  0  0  0
    5.0090   -1.9549   -2.7644 C   0  0  0  0  0
    5.3350   -1.9463   -1.4076 C   0  0  0  0  0
    5.3147   -0.7557   -0.6653 C   0  0  0  0  0
    5.6586   -0.7614    0.6950 C   0  0  0  0  0
    5.6678    0.4172    1.4400 C   0  0  0  0  0
    4.4703    2.9056   -1.1037 C   0  0  0  0  0
    5.3308    3.6311   -1.6011 O   0  0  0  0  0
    3.1506    3.2546   -1.2115 N   0  0  0  0  0
    1.8793    2.7544   -0.6120 C   0  0  0  0  0
    1.5422    1.2757   -0.9347 C   0  0  0  0  0
    1.7706    0.5844    0.3729 C   0  0  0  0  0
    1.8083   -0.7804    0.6096 C   0  0  0  0  0
    2.0145   -1.2232    1.9176 C   0  0  0  0  0
    2.1656   -0.3043    2.9667 C   0  0  0  0  0
    2.1179    1.0684    2.7192 C   0  0  0  0  0
    1.9279    1.4979    1.4159 C   0  0  0  0  0
    1.8517    2.9125    0.9313 C   0  0  0  0  0
    0.7341    3.6191   -1.1894 C   0  0  0  0  0
   -0.4608    3.5040   -0.9602 O   0  0  0  0  0
    1.1549    4.5981   -2.0246 O   0  0  0  0  0
    8.3720    4.2670    1.6232 H   0  0  0  0  0
    6.8603    4.8953    0.9256 H   0  0  0  0  0
    7.6146    3.4605    0.2344 H   0  0  0  0  0
    6.4234    3.6703    3.0480 H   0  0  0  0  0
    7.1987    2.2298    2.4084 H   0  0  0  0  0
    4.3762    1.3372   -3.2028 H   0  0  0  0  0
    4.4263   -0.7636   -4.4584 H   0  0  0  0  0
    5.0322   -2.8853   -3.3241 H   0  0  0  0  0
    5.6115   -2.8856   -0.9331 H   0  0  0  0  0
    5.9274   -1.6925    1.1904 H   0  0  0  0  0
    5.9224    0.3742    2.4945 H   0  0  0  0  0
    3.0468    4.1437   -1.6956 H   0  0  0  0  0
    2.1616    0.8657   -1.7318 H   0  0  0  0  0
    0.4935    1.1329   -1.2204 H   0  0  0  0  0
    1.6938   -1.4925   -0.2018 H   0  0  0  0  0
    2.0595   -2.2891    2.1254 H   0  0  0  0  0
    2.3237   -0.6645    3.9798 H   0  0  0  0  0
    2.2390    1.7804    3.5297 H   0  0  0  0  0
    2.6942    3.5040    1.3015 H   0  0  0  0  0
    0.9209    3.3629    1.2941 H   0  0  0  0  0
    0.3268    5.0412   -2.3084 H   0  0  0  0  0
  1  2  1  0  0  0
  1 29  1  0  0  0
  1 30  1  0  0  0
  1 31  1  0  0  0
  2  3  1  0  0  0
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  2 33  1  0  0  0
  3  4  1  0  0  0
  4 13  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
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M  END

>  <Chemical Name>
SCHEMBL3309293

>  <PubChem CID>
59314091

>  <Formula>
C23H21NO4

>  <Molecular Weight>
375.424000

>  <IUPAC Name>
2-[(2-ethoxynaphthalene-1-carbonyl)amino]-1,3-dihydroindene-2-carboxylic acid

>  <XlogP>
4.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3(CC4=CC=CC=C4C3)C(=O)O

>  <Isomeric SMILES>
CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3(CC4=CC=CC=C4C3)C(=O)O

>  <InChI Std. ID>
InChI=1S/C23H21NO4/c1-2-28-19-12-11-15-7-5-6-10-18(15)20(19)21(25)24-23(22(26)27)13-16-8-3-4-9-17(16)14-23/h3-12H,2,13-14H2,1H3,(H,24,25)(H,26,27)

>  <InChI Key>
HRPVFPJSKUAKRD-UHFFFAOYSA-N

