[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-(ethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-(ethylsulfamoyl)-2-methyl-benzoate Openeye Name: [2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl] 5-(ethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(ethylsulfamoyl)-2-methylbenzoic acid [2-(4-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitroanilino)-2-oxoethyl] 5-(ethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(ethylsulfamoyl)-2-methyl-benzoic acid [2-keto-2-(4-methyl-3-nitro-anilino)ethyl] ester Formula: C19H21N3O7S MolecularWeight: 435.45094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OCC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OCC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O7S/c1-4-20-30(27,28)15-8-6-12(2)16(10-15)19(24)29-11-18(23)21-14-7-5-13(3)17(9-14)22(25)26/h5-10,20H,4,11H2,1-3H3,(H,21,23)