[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(dimethylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(dimethylsulfamoyl)-4-methoxy-benzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3-(dimethylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(dimethylsulfamoyl)-4-methoxybenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3-(dimethylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(dimethylsulfamoyl)-4-methoxy-benzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H19N3O6S MolecularWeight: 369.39286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O6S/c1-18(2)25(21,22)13-9-11(5-6-12(13)23-3)15(20)24-10-14(19)17-8-4-7-16/h5-6,9H,4,8,10H2,1-3H3,(H,17,19)