[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: [2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl] 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid [2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C15H11ClFN3O7S MolecularWeight: 431.780143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl)[N+](=O)[O-])F

InChI

InChI=1S/C15H11ClFN3O7S/c16-11-3-2-9(28(18,25)26)6-10(11)15(22)27-7-14(21)19-8-1-4-12(17)13(5-8)20(23)24/h1-6H,7H2,(H,19,21)(H2,18,25,26)