[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 4-(cyclopropylsulfamoyl)benzoate

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 4-(cyclopropylsulfamoyl)benzoate Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl] 4-(cyclopropylsulfamoyl)benzoate CAS Name: 4-(cyclopropylsulfamoyl)benzoic acid [2-(2-chloro-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl] 4-(cyclopropylsulfamoyl)benzoate Traditional Name: 4-(cyclopropylsulfamoyl)benzoic acid [2-(2-chloro-4-nitro-anilino)-2-keto-ethyl] ester Formula: C18H16ClN3O7S MolecularWeight: 453.85354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O7S/c19-15-9-13(22(25)26)5-8-16(15)20-17(23)10-29-18(24)11-1-6-14(7-2-11)30(27,28)21-12-3-4-12/h1-2,5-9,12,21H,3-4,10H2,(H,20,23)