(2-oxidanylidenepyrrolidin-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-oxidanylidenepyrrolidin-3-yl) 4-methylbenzenesulfonate Openeye Name: (2-oxopyrrolidin-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-oxo-3-pyrrolidinyl) ester IUPAC Name: (2-oxopyrrolidin-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-ketopyrrolidin-3-yl) ester Formula: C11H13NO4S MolecularWeight: 255.29022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCNC2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCNC2=O

InChI

InChI=1S/C11H13NO4S/c1-8-2-4-9(5-3-8)17(14,15)16-10-6-7-12-11(10)13/h2-5,10H,6-7H2,1H3,(H,12,13)