(1-ethanoyl-3-ethyl-azetidin-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-ethanoyl-3-ethyl-azetidin-3-yl) 4-methylbenzenesulfonate Openeye Name: (1-acetyl-3-ethyl-azetidin-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-acetyl-3-ethyl-3-azetidinyl) ester IUPAC Name: (1-acetyl-3-ethylazetidin-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-acetyl-3-ethyl-azetidin-3-yl) ester Formula: C14H19NO4S MolecularWeight: 297.36996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C1)C(=O)C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC1(CN(C1)C(=O)C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H19NO4S/c1-4-14(9-15(10-14)12(3)16)19-20(17,18)13-7-5-11(2)6-8-13/h5-8H,4,9-10H2,1-3H3