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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C22H19N3O8S2/c23-34(29,30)21-6-2-4-18(14-21)24-35(31,32)20-10-7-16(8-11-20)9-12-22(26)33-15-17-3-1-5-19(13-17)25(27)28/h1-14,24H,15H2,(H2,23,29,30)/b12-9+