[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C16H14ClN3O6 MolecularWeight: 379.75186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-])Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-])Cl)N

InChI

InChI=1S/C16H14ClN3O6/c1-25-14-7-11(18)10(17)6-9(14)16(22)26-8-15(21)19-12-4-2-3-5-13(12)20(23)24/h2-7H,8,18H2,1H3,(H,19,21)