2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(4-methyl-4-morpholin-4-iumyl)ethyl ester IUPAC Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(4-methylmorpholin-4-ium-4-yl)ethyl ester Formula: C14H22NO4S+ MolecularWeight: 300.39378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC[N+]2(CCOCC2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC[N+]2(CCOCC2)C

InChI

InChI=1S/C14H22NO4S/c1-13-3-5-14(6-4-13)20(16,17)19-12-9-15(2)7-10-18-11-8-15/h3-6H,7-12H2,1-2H3/q+1