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

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C14H10ClN3O5 MolecularWeight: 335.6993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN3O5/c15-11-4-3-10(6-12(11)18(21)22)17-13(19)8-23-14(20)9-2-1-5-16-7-9/h1-7H,8H2,(H,17,19)