2-[5-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]indol-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[5-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]indol-1-yl]carbonylbenzoic acid Openeye Name: 2-[5-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]indole-1-carbonyl]benzoic acid CAS Name: 2-[[5-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]-1-indolyl]-oxomethyl]benzoic acid IUPAC Name: 2-[5-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]indole-1-carbonyl]benzoic acid Traditional Name: 2-[5-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]indole-1-carbonyl]benzoic acid Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC4=C(C=C3)N(C=C4)C(=O)C5=CC=CC=C5C(=O)O)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC4=C(C=C3)N(C=C4)C(=O)C5=CC=CC=C5C(=O)O)N=C(C=C2C)C

InChI

InChI=1S/C27H24N4O3/c1-4-23-29-24-16(2)13-17(3)28-25(24)31(23)15-18-9-10-22-19(14-18)11-12-30(22)26(32)20-7-5-6-8-21(20)27(33)34/h5-14H,4,15H2,1-3H3,(H,33,34)