3-[4-(cyclopropylcarbamoyl)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-[4-(cyclopropylcarbamoyl)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 3-[4-(cyclopropylcarbamoyl)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid CAS Name: 3-[4-[(cyclopropylamino)-oxomethyl]phenyl]-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-[4-(cyclopropylcarbamoyl)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 3-[4-(cyclopropylcarbamoyl)phenyl]-1-m-anisyl-indole-2-carboxylic acid Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C4=CC=C(C=C4)C(=O)NC5CC5

Isomeric SMILES

COC1=CC=CC(=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C4=CC=C(C=C4)C(=O)NC5CC5

InChI

InChI=1S/C27H24N2O4/c1-33-21-6-4-5-17(15-21)16-29-23-8-3-2-7-22(23)24(25(29)27(31)32)18-9-11-19(12-10-18)26(30)28-20-13-14-20/h2-12,15,20H,13-14,16H2,1H3,(H,28,30)(H,31,32)