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

Systemtic Name: (4-nitrophenyl)methyl 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: (4-nitrophenyl)methyl 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid (4-nitrobenzyl) ester Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O6S/c24-21(29-15-17-9-11-19(12-10-17)23(25)26)18-7-4-8-20(13-18)30(27,28)22-14-16-5-2-1-3-6-16/h1-13,22H,14-15H2