[2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] quinoxaline-6-carboxylate

Systemtic Name: [2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] quinoxaline-6-carboxylate Openeye Name: [2-(4-chloro-2-nitro-anilino)-2-oxo-ethyl] quinoxaline-6-carboxylate CAS Name: 6-quinoxalinecarboxylic acid [2-(4-chloro-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-2-nitroanilino)-2-oxoethyl] quinoxaline-6-carboxylate Traditional Name: quinoxaline-6-carboxylic acid [2-(4-chloro-2-nitro-anilino)-2-keto-ethyl] ester Formula: C17H11ClN4O5 MolecularWeight: 386.74604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=CN=C2C=C1C(=O)OCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NC=CN=C2C=C1C(=O)OCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H11ClN4O5/c18-11-2-4-13(15(8-11)22(25)26)21-16(23)9-27-17(24)10-1-3-12-14(7-10)20-6-5-19-12/h1-8H,9H2,(H,21,23)