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3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-yl-propan-1-ol; methyl sulfate

3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-yl-propan-1-ol; methyl sulfate

Systemtic Name:3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-yl-propan-1-ol; methyl sulfate
Openeye Name:3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-(2-thienyl)propan-1-ol; methyl sulfate
CAS Name:3-(4-methyl-4-morpholin-4-iumyl)-1-phenyl-1-thiophen-2-yl-1-propanol; methyl sulfate
IUPAC Name:3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-ylpropan-1-ol; methyl sulfate
Traditional Name:3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-(2-thienyl)propan-1-ol; methyl sulfate
Formula: C19H27NO6S2
MolecularWeight: 429.55078
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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O.COS(=O)(=O)[O-]


Isomeric SMILES

C[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O.COS(=O)(=O)[O-]


InChI

InChI=1S/C18H24NO2S.CH4O4S/c1-19(11-13-21-14-12-19)10-9-18(20,17-8-5-15-22-17)16-6-3-2-4-7-16;1-5-6(2,3)4/h2-8,15,20H,9-14H2,1H3;1H3,(H,2,3,4)/q+1;/p-1


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