10-(3-phenylheptylsulfanyl)decan-2-ylperoxycarbonyl-propoxy-phosphinic acid

Systemtic Name: 10-(3-phenylheptylsulfanyl)decan-2-ylperoxycarbonyl-propoxy-phosphinic acid Openeye Name: [1-methyl-9-(3-phenylheptylsulfanyl)nonyl]peroxycarbonyl-propoxy-phosphinic acid CAS Name: [oxo-[10-(3-phenylheptylthio)decan-2-yldioxy]methyl]-propoxyphosphinic acid IUPAC Name: 10-(3-phenylheptylsulfanyl)decan-2-ylperoxycarbonyl-propoxyphosphinic acid Traditional Name: [1-methyl-9-(3-phenylheptylthio)nonyl]peroxycarbonyl-propoxy-phosphinic acid Formula: C27H47O6PS MolecularWeight: 530.697241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCSCCCCCCCCC(C)OOC(=O)P(=O)(O)OCCC)C1=CC=CC=C1

Isomeric SMILES

CCCCC(CCSCCCCCCCCC(C)OOC(=O)P(=O)(O)OCCC)C1=CC=CC=C1

InChI

InChI=1S/C27H47O6PS/c1-4-6-17-26(25-18-13-11-14-19-25)20-23-35-22-15-10-8-7-9-12-16-24(3)32-33-27(28)34(29,30)31-21-5-2/h11,13-14,18-19,24,26H,4-10,12,15-17,20-23H2,1-3H3,(H,29,30)