(1-morpholin-4-yl-1-oxidanylidene-pentan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-pentan-2-yl) 4-methylbenzenesulfonate Openeye Name: 1-(morpholine-4-carbonyl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-morpholinyl)-1-oxopentan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopentan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-(morpholine-4-carbonyl)butyl ester Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCOCC1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(C(=O)N1CCOCC1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H23NO5S/c1-3-4-15(16(18)17-9-11-21-12-10-17)22-23(19,20)14-7-5-13(2)6-8-14/h5-8,15H,3-4,9-12H2,1-2H3