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

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 4-methylbenzenesulfonate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)N2CCOCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)N2CCOCC2

InChI

InChI=1S/C14H19NO5S/c1-11-3-5-13(6-4-11)21(17,18)20-12(2)14(16)15-7-9-19-10-8-15/h3-6,12H,7-10H2,1-2H3