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

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-(2-chloro-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(2-chloro-4-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=C1[N+](=O)[O-])Cl)NC(=O)COC(=O)C2=CC=NC=C2

Isomeric SMILES

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

InChI

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