[2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] imidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl] imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 2-imidazo[1,2-a]pyridinecarboxylic acid [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] imidazo[1,2-a]pyridine-2-carboxylate Traditional Name: imidazo[1,2-a]pyridine-2-carboxylic acid [2-(4,5-dimethyl-2-nitro-anilino)-2-keto-ethyl] ester Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)C2=CN3C=CC=CC3=N2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)C2=CN3C=CC=CC3=N2

InChI

InChI=1S/C18H16N4O5/c1-11-7-13(15(22(25)26)8-12(11)2)20-17(23)10-27-18(24)14-9-21-6-4-3-5-16(21)19-14/h3-9H,10H2,1-2H3,(H,20,23)