[3-(dimethylsulfamoyl)phenyl]methyl 1-cyanocyclopentane-1-carboxylate

Systemtic Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-cyanocyclopentane-1-carboxylate Openeye Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-cyanocyclopentanecarboxylate CAS Name: 1-cyano-1-cyclopentanecarboxylic acid [3-(dimethylsulfamoyl)phenyl]methyl ester IUPAC Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-cyanocyclopentane-1-carboxylate Traditional Name: 1-cyanocyclopentanecarboxylic acid [3-(dimethylsulfamoyl)benzyl] ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2(CCCC2)C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2(CCCC2)C#N

InChI

InChI=1S/C16H20N2O4S/c1-18(2)23(20,21)14-7-5-6-13(10-14)11-22-15(19)16(12-17)8-3-4-9-16/h5-7,10H,3-4,8-9,11H2,1-2H3