(3-nitrophenyl)methyl 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate

Systemtic Name: (3-nitrophenyl)methyl 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: (3-nitrophenyl)methyl 3-[allyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 3-[allyl(phenyl)sulfamoyl]benzoic acid (3-nitrobenzyl) ester Formula: C23H20N2O6S MolecularWeight: 452.4797

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O6S/c1-2-14-24(20-10-4-3-5-11-20)32(29,30)22-13-7-9-19(16-22)23(26)31-17-18-8-6-12-21(15-18)25(27)28/h2-13,15-16H,1,14,17H2