3-hexadecylsulfanylcyclohexan-1-ol; phosphoric acid

Systemtic Name: 3-hexadecylsulfanylcyclohexan-1-ol; phosphoric acid Openeye Name: 3-hexadecylsulfanylcyclohexanol; phosphoric acid CAS Name: 3-(hexadecylthio)-1-cyclohexanol; phosphoric acid IUPAC Name: 3-hexadecylsulfanylcyclohexan-1-ol; phosphoric acid Traditional Name: 3-(cetylthio)cyclohexanol; phosphoric acid Formula: C22H47O5PS MolecularWeight: 454.644341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1CCCC(C1)O.OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1CCCC(C1)O.OP(=O)(O)O

InChI

InChI=1S/C22H44OS.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-22-18-16-17-21(23)20-22;1-5(2,3)4/h21-23H,2-20H2,1H3;(H3,1,2,3,4)