(1-methanoylpyrrolidin-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-methanoylpyrrolidin-3-yl) 4-methylbenzenesulfonate Openeye Name: (1-formylpyrrolidin-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-formyl-3-pyrrolidinyl) ester IUPAC Name: (1-formylpyrrolidin-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-formylpyrrolidin-3-yl) ester Formula: C12H15NO4S MolecularWeight: 269.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCN(C2)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCN(C2)C=O

InChI

InChI=1S/C12H15NO4S/c1-10-2-4-12(5-3-10)18(15,16)17-11-6-7-13(8-11)9-14/h2-5,9,11H,6-8H2,1H3