[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(3-bromophenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(3-bromophenyl)prop-2-enoate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(3-bromophenyl)prop-2-enoate CAS Name: (E)-3-(3-bromophenyl)-2-propenoic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(3-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromophenyl)acrylic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C18H17BrN2O5S MolecularWeight: 453.30698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=CC(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)/C=C/C(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H17BrN2O5S/c19-15-3-1-2-13(10-15)6-9-18(23)26-12-17(22)21-11-14-4-7-16(8-5-14)27(20,24)25/h1-10H,11-12H2,(H,21,22)(H2,20,24,25)/b9-6+