cyclohexyl-(2-diethoxyphosphorylsulfanylethyl)-dimethyl-azanium; methyl sulfate

Systemtic Name: cyclohexyl-(2-diethoxyphosphorylsulfanylethyl)-dimethyl-azanium; methyl sulfate Openeye Name: cyclohexyl-(2-diethoxyphosphorylsulfanylethyl)-dimethyl-ammonium; methyl sulfate CAS Name: cyclohexyl-[2-(diethoxyphosphorylthio)ethyl]-dimethylammonium; methyl sulfate IUPAC Name: cyclohexyl-(2-diethoxyphosphorylsulfanylethyl)-dimethylazanium; methyl sulfate Traditional Name: cyclohexyl-[2-(diethoxyphosphorylthio)ethyl]-dimethyl-ammonium; methyl sulfate Formula: C15H34NO7PS2 MolecularWeight: 435.536721

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)SCC[N+](C)(C)C1CCCCC1.COS(=O)(=O)[O-]

Isomeric SMILES

CCOP(=O)(OCC)SCC[N+](C)(C)C1CCCCC1.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H31NO3PS.CH4O4S/c1-5-17-19(16,18-6-2)20-13-12-15(3,4)14-10-8-7-9-11-14;1-5-6(2,3)4/h14H,5-13H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1