3-cyanopropyl 4-(dimethylsulfamoyl)benzoate

Systemtic Name: 3-cyanopropyl 4-(dimethylsulfamoyl)benzoate Openeye Name: 3-cyanopropyl 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid 3-cyanopropyl ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCCC#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCCC#N

InChI

InChI=1S/C13H16N2O4S/c1-15(2)20(17,18)12-7-5-11(6-8-12)13(16)19-10-4-3-9-14/h5-8H,3-4,10H2,1-2H3