3-[(2-chloranyl-6-phenyl-pyridin-3-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid

Systemtic Name: 3-[(2-chloranyl-6-phenyl-pyridin-3-yl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[(2-chloro-6-phenyl-3-pyridyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(2-chloro-6-phenyl-3-pyridinyl)methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-6-phenylpyridin-3-yl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-[(2-chloro-6-phenyl-3-pyridyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C20H15ClN4O2 MolecularWeight: 378.8117

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN4O2/c1-12-22-16-9-10-17(20(26)27)24-19(16)25(12)11-14-7-8-15(23-18(14)21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,26,27)