(3-nitrophenyl)methyl 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (3-nitrophenyl)methyl 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Openeye Name: (3-nitrophenyl)methyl 3-[methyl(p-tolyl)sulfamoyl]benzoate CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]benzoic acid (3-nitrobenzyl) ester Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O6S/c1-16-9-11-19(12-10-16)23(2)31(28,29)21-8-4-6-18(14-21)22(25)30-15-17-5-3-7-20(13-17)24(26)27/h3-14H,15H2,1-2H3