methyl sulfate; (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-(4-methylmorpholin-4-ium-4-yl)ethanoate

Systemtic Name: methyl sulfate; (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-(4-methylmorpholin-4-ium-4-yl)ethanoate Openeye Name: methyl sulfate; (1,7,7-trimethylnorbornan-2-yl) 2-(4-methylmorpholin-4-ium-4-yl)acetate CAS Name: 2-(4-methyl-4-morpholin-4-iumyl)acetic acid (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) ester; methyl sulfate IUPAC Name: methyl sulfate; (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-(4-methylmorpholin-4-ium-4-yl)acetate Traditional Name: 2-(4-methylmorpholin-4-ium-4-yl)acetic acid 2-bornyl ester; methyl sulfate Formula: C18H33NO7S MolecularWeight: 407.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)OC(=O)C[N+]3(CCOCC3)C)C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1(C2CCC1(C(C2)OC(=O)C[N+]3(CCOCC3)C)C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C17H30NO3.CH4O4S/c1-16(2)13-5-6-17(16,3)14(11-13)21-15(19)12-18(4)7-9-20-10-8-18;1-5-6(2,3)4/h13-14H,5-12H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1