[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-(5-chloro-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2-nitroanilino)-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(5-chloro-2-nitro-anilino)-2-keto-ethyl] ester Formula: C14H10ClN3O5 MolecularWeight: 335.6993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NC(=O)COC(=O)C2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)NC(=O)COC(=O)C2=CC=NC=C2)[N+](=O)[O-]

InChI

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