2-oxidanylidenepropyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: 2-oxidanylidenepropyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: acetonyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid acetonyl ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC#N

Isomeric SMILES

CC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC#N

InChI

InChI=1S/C13H14N2O5S/c1-10(16)9-20-13(17)11-3-5-12(6-4-11)21(18,19)15-8-2-7-14/h3-6,15H,2,8-9H2,1H3