1-[[4-(2-carboxyphenyl)phenyl]methyl]-2-cyclopropyl-4-methyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid

Systemtic Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-2-cyclopropyl-4-methyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid Openeye Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-2-cyclopropyl-4-methyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid CAS Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-2-cyclopropyl-4-methyl-6-pyrrolo[2,3-b]pyridinecarboxylic acid IUPAC Name: 1-[[4-(2-carboxyphenyl)phenyl]methyl]-2-cyclopropyl-4-methylpyrrolo[2,3-b]pyridine-6-carboxylic acid Traditional Name: 1-[4-(2-carboxyphenyl)benzyl]-2-cyclopropyl-4-methyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(N2CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CC5)C(=O)O

Isomeric SMILES

CC1=CC(=NC2=C1C=C(N2CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CC5)C(=O)O

InChI

InChI=1S/C26H22N2O4/c1-15-12-22(26(31)32)27-24-21(15)13-23(18-10-11-18)28(24)14-16-6-8-17(9-7-16)19-4-2-3-5-20(19)25(29)30/h2-9,12-13,18H,10-11,14H2,1H3,(H,29,30)(H,31,32)