(3-methylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (3-methylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: m-tolylmethyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-methylbenzyl) ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

InChI

InChI=1S/C18H18N2O4S/c1-14-4-2-5-15(12-14)13-24-18(21)16-6-8-17(9-7-16)25(22,23)20-11-3-10-19/h2,4-9,12,20H,3,11,13H2,1H3