(4-cyanophenyl)methyl 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: (4-cyanophenyl)methyl 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: (4-cyanophenyl)methyl 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[methyl-(phenylmethyl)sulfamoyl]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 5-[benzyl(methyl)sulfamoyl]-2-chlorobenzoate Traditional Name: 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoic acid (4-cyanobenzyl) ester Formula: C23H19ClN2O4S MolecularWeight: 454.92596

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H19ClN2O4S/c1-26(15-18-5-3-2-4-6-18)31(28,29)20-11-12-22(24)21(13-20)23(27)30-16-19-9-7-17(14-25)8-10-19/h2-13H,15-16H2,1H3