[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-(diethylsulfamoyl)benzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-(diethylsulfamoyl)benzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-(diethylsulfamoyl)benzoate CAS Name: 4-(diethylsulfamoyl)benzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-(diethylsulfamoyl)benzoate Traditional Name: 4-(diethylsulfamoyl)benzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C16H21N3O5S/c1-3-19(4-2)25(22,23)14-8-6-13(7-9-14)16(21)24-12-15(20)18-11-5-10-17/h6-9H,3-5,11-12H2,1-2H3,(H,18,20)