methyl 3-[(2-chloranyl-4-nitro-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-[(2-chloranyl-4-nitro-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[(2-chloro-4-nitro-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[(2-chloro-4-nitrophenyl)methyl]-2,7-dimethyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-4-nitrophenyl)methyl]-2,7-dimethylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-(2-chloro-4-nitro-benzyl)-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C17H15ClN4O4 MolecularWeight: 374.7784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1N=C(N2CC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C)C(=O)OC

Isomeric SMILES

CC1=CC(=NC2=C1N=C(N2CC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C)C(=O)OC

InChI

InChI=1S/C17H15ClN4O4/c1-9-6-14(17(23)26-3)20-16-15(9)19-10(2)21(16)8-11-4-5-12(22(24)25)7-13(11)18/h4-7H,8H2,1-3H3