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

Systemtic Name: 3-[(2-chloranyl-4-nitro-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[(2-chloro-4-nitro-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(2-chloro-4-nitrophenyl)methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-4-nitrophenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-(2-chloro-4-nitro-benzyl)-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C15H11ClN4O4 MolecularWeight: 346.72524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=C(C=C2)C(=O)O

InChI

InChI=1S/C15H11ClN4O4/c1-8-17-12-4-5-13(15(21)22)18-14(12)19(8)7-9-2-3-10(20(23)24)6-11(9)16/h2-6H,7H2,1H3,(H,21,22)