[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] (E)-3-(2-nitrophenyl)prop-2-enoate

Systemtic Name: [1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] (E)-3-(2-nitrophenyl)prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] (E)-3-(2-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(2-nitrophenyl)-2-propenoic acid [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] (E)-3-(2-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(2-nitrophenyl)acrylic acid [2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C18H17N3O7S MolecularWeight: 419.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O7S/c1-12(18(23)20-14-7-9-15(10-8-14)29(19,26)27)28-17(22)11-6-13-4-2-3-5-16(13)21(24)25/h2-12H,1H3,(H,20,23)(H2,19,26,27)/b11-6+