(4-nitrophenyl)methyl (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoate

Systemtic Name: (4-nitrophenyl)methyl (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoate Openeye Name: (4-nitrophenyl)methyl (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]-2-propenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(3-sulfamoylphenyl)sulfamoyl]phenyl]acrylic acid (4-nitrobenzyl) ester Formula: C22H19N3O8S2 MolecularWeight: 517.53156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O8S2/c23-34(29,30)21-3-1-2-18(14-21)24-35(31,32)20-11-6-16(7-12-20)8-13-22(26)33-15-17-4-9-19(10-5-17)25(27)28/h1-14,24H,15H2,(H2,23,29,30)/b13-8+