2-cyclopropyl-3-hexadecylsulfanyl-propan-1-ol; phosphoric acid

Systemtic Name: 2-cyclopropyl-3-hexadecylsulfanyl-propan-1-ol; phosphoric acid Openeye Name: 2-cyclopropyl-3-hexadecylsulfanyl-propan-1-ol; phosphoric acid CAS Name: 2-cyclopropyl-3-(hexadecylthio)-1-propanol; phosphoric acid IUPAC Name: 2-cyclopropyl-3-hexadecylsulfanylpropan-1-ol; phosphoric acid Traditional Name: 3-(cetylthio)-2-cyclopropyl-propan-1-ol; phosphoric acid Formula: C22H47O5PS MolecularWeight: 454.644341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(CO)C1CC1.OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(CO)C1CC1.OP(=O)(O)O

InChI

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