[(1R)-1-cyanoethyl] 5-(dimethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 5-(dimethylsulfamoyl)-2-methyl-benzoate Openeye Name: [(1R)-1-cyanoethyl] 5-(dimethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-methylbenzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 5-(dimethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-methyl-benzoic acid [(1R)-1-cyanoethyl] ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4S/c1-9-5-6-11(20(17,18)15(3)4)7-12(9)13(16)19-10(2)8-14/h5-7,10H,1-4H3/t10-/m1/s1