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

Systemtic Name: 10-(3-cyclohexylheptylsulfanyl)decan-2-ylperoxycarbonyl-propoxy-phosphinic acid Openeye Name: [9-(3-cyclohexylheptylsulfanyl)-1-methyl-nonyl]peroxycarbonyl-propoxy-phosphinic acid CAS Name: [10-(3-cyclohexylheptylthio)decan-2-yldioxy-oxomethyl]-propoxyphosphinic acid IUPAC Name: 10-(3-cyclohexylheptylsulfanyl)decan-2-ylperoxycarbonyl-propoxyphosphinic acid Traditional Name: [9-(3-cyclohexylheptylthio)-1-methyl-nonyl]peroxycarbonyl-propoxy-phosphinic acid Formula: C27H53O6PS MolecularWeight: 536.744881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCSCCCCCCCCC(C)OOC(=O)P(=O)(O)OCCC)C1CCCCC1

Isomeric SMILES

CCCCC(CCSCCCCCCCCC(C)OOC(=O)P(=O)(O)OCCC)C1CCCCC1

InChI

InChI=1S/C27H53O6PS/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/h24-26H,4-23H2,1-3H3,(H,29,30)