(3,5-dimethylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (3,5-dimethylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (3,5-dimethylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3,5-dimethylbenzyl) ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-14-10-15(2)12-16(11-14)13-25-19(22)17-4-6-18(7-5-17)26(23,24)21-9-3-8-20/h4-7,10-12,21H,3,9,13H2,1-2H3