[(1R)-1-cyanoethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Openeye Name: [(1R)-1-cyanoethyl] 3-[methyl(p-tolyl)sulfamoyl]benzoate CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]benzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]benzoic acid [(1R)-1-cyanoethyl] ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)O[C@H](C)C#N

InChI

InChI=1S/C18H18N2O4S/c1-13-7-9-16(10-8-13)20(3)25(22,23)17-6-4-5-15(11-17)18(21)24-14(2)12-19/h4-11,14H,1-3H3/t14-/m1/s1