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

Systemtic Name: (4-nitrophenyl)methyl 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: (4-nitrophenyl)methyl 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 3-[(3-chlorophenyl)-methylsulfamoyl]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(3-chlorophenyl)-methylsulfamoyl]benzoate Traditional Name: 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoic acid (4-nitrobenzyl) ester Formula: C21H17ClN2O6S MolecularWeight: 460.88748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O6S/c1-23(19-6-3-5-17(22)13-19)31(28,29)20-7-2-4-16(12-20)21(25)30-14-15-8-10-18(11-9-15)24(26)27/h2-13H,14H2,1H3