methyl 3-[(2-chloranyl-4-pyrrol-1-yl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-[(2-chloranyl-4-pyrrol-1-yl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[(2-chloro-4-pyrrol-1-yl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[[2-chloro-4-(1-pyrrolyl)phenyl]methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-4-pyrrol-1-ylphenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-(2-chloro-4-pyrrol-1-yl-benzyl)-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C20H17ClN4O2 MolecularWeight: 380.82758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)N4C=CC=C4)Cl)N=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)N4C=CC=C4)Cl)N=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H17ClN4O2/c1-13-22-17-7-8-18(20(26)27-2)23-19(17)25(13)12-14-5-6-15(11-16(14)21)24-9-3-4-10-24/h3-11H,12H2,1-2H3