(3-morpholin-4-ylcyclobutyl) 4-methylbenzenesulfonate

Systemtic Name: (3-morpholin-4-ylcyclobutyl) 4-methylbenzenesulfonate Openeye Name: (3-morpholinocyclobutyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(4-morpholinyl)cyclobutyl] ester IUPAC Name: (3-morpholin-4-ylcyclobutyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-morpholinocyclobutyl) ester Formula: C15H21NO4S MolecularWeight: 311.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)N3CCOCC3

InChI

InChI=1S/C15H21NO4S/c1-12-2-4-15(5-3-12)21(17,18)20-14-10-13(11-14)16-6-8-19-9-7-16/h2-5,13-14H,6-11H2,1H3