3-(3-dodecylsulfanyl-2-phenyl-hexyl)sulfanylpropoxy-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: 3-(3-dodecylsulfanyl-2-phenyl-hexyl)sulfanylpropoxy-oxidanyl-oxidanylidene-phosphanium Openeye Name: 3-(3-dodecylsulfanyl-2-phenyl-hexyl)sulfanylpropoxy-hydroxy-oxo-phosphonium CAS Name: 3-[[3-(dodecylthio)-2-phenylhexyl]thio]propoxy-hydroxy-oxophosphonium IUPAC Name: 3-(3-dodecylsulfanyl-2-phenylhexyl)sulfanylpropoxy-hydroxy-oxophosphanium Traditional Name: hydroxy-keto-[3-[[3-(laurylthio)-2-phenyl-hexyl]thio]propoxy]phosphonium Formula: C27H48O3PS2+ MolecularWeight: 515.771981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(CCC)C(CSCCCO[P+](=O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCSC(CCC)C(CSCCCO[P+](=O)O)C1=CC=CC=C1

InChI

InChI=1S/C27H47O3PS2/c1-3-5-6-7-8-9-10-11-12-16-23-33-27(18-4-2)26(25-19-14-13-15-20-25)24-32-22-17-21-30-31(28)29/h13-15,19-20,26-27H,3-12,16-18,21-24H2,1-2H3/p+1