(2-azanyl-2-oxidanylidene-ethyl) 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-amino-2-keto-ethyl) ester Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O5S/c13-6-1-7-15-21(18,19)10-4-2-9(3-5-10)12(17)20-8-11(14)16/h2-5,15H,1,7-8H2,(H2,14,16)