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2-[3-(4-cyano-3-methyl-phenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-carboxylic acid

2-[3-(4-cyano-3-methyl-phenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-carboxylic acid

Systemtic Name:2-[3-(4-cyano-3-methyl-phenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-carboxylic acid
Openeye Name:2-[3-(4-cyano-3-methyl-phenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid
CAS Name:2-[3-(4-cyano-3-methylphenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid
IUPAC Name:2-[3-(4-cyano-3-methylphenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid
Traditional Name:2-[3-(4-cyano-3-methyl-phenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid
Formula: C26H17N3O3
MolecularWeight: 419.43148
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)C(=O)O)C#N


Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)C(=O)O)C#N


InChI

InChI=1S/C26H17N3O3/c1-14-9-16(5-6-19(14)13-27)15-3-2-4-18(10-15)25-28-21-8-7-17-11-20(26(31)32)12-22(30)23(17)24(21)29-25/h2-12,30H,1H3,(H,28,29)(H,31,32)


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