4-(2-ethylhexyl)-4-methyl-morpholin-4-ium; methyl hydrogen sulfate

Systemtic Name: 4-(2-ethylhexyl)-4-methyl-morpholin-4-ium; methyl hydrogen sulfate Openeye Name: 4-(2-ethylhexyl)-4-methyl-morpholin-4-ium; methyl hydrogen sulfate CAS Name: 4-(2-ethylhexyl)-4-methylmorpholin-4-ium; sulfuric acid methyl ester IUPAC Name: 4-(2-ethylhexyl)-4-methylmorpholin-4-ium; methyl hydrogen sulfate Traditional Name: 4-(2-ethylhexyl)-4-methyl-morpholin-4-ium; sulfuric acid methyl ester Formula: C14H32NO5S+ MolecularWeight: 326.47258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[N+]1(CCOCC1)C.COS(=O)(=O)O

Isomeric SMILES

CCCCC(CC)C[N+]1(CCOCC1)C.COS(=O)(=O)O

InChI

InChI=1S/C13H28NO.CH4O4S/c1-4-6-7-13(5-2)12-14(3)8-10-15-11-9-14;1-5-6(2,3)4/h13H,4-12H2,1-3H3;1H3,(H,2,3,4)/q+1;