[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,6-bis(chloranyl)pyridine-4-carboxylate

Systemtic Name: [2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,6-bis(chloranyl)pyridine-4-carboxylate Openeye Name: [2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl] 2,6-dichloropyridine-4-carboxylate CAS Name: 2,6-dichloro-4-pyridinecarboxylic acid [2-(4-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitroanilino)-2-oxoethyl] 2,6-dichloropyridine-4-carboxylate Traditional Name: 2,6-dichloroisonicotinic acid [2-keto-2-(4-methyl-3-nitro-anilino)ethyl] ester Formula: C15H11Cl2N3O5 MolecularWeight: 384.17094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=NC(=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=NC(=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11Cl2N3O5/c1-8-2-3-10(6-11(8)20(23)24)18-14(21)7-25-15(22)9-4-12(16)19-13(17)5-9/h2-6H,7H2,1H3,(H,18,21)