cyanomethyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: cyanomethyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: cyanomethyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid cyanomethyl ester Formula: C12H11N3O4S MolecularWeight: 293.29844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC#N)S(=O)(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC#N)S(=O)(=O)NCCC#N

InChI

InChI=1S/C12H11N3O4S/c13-6-1-8-15-20(17,18)11-4-2-10(3-5-11)12(16)19-9-7-14/h2-5,15H,1,8-9H2