8-methyl-2-(6-methylheptyl)-2-(6-methylheptylsulfanyl)nonanoate; phosphorous acid

Systemtic Name: 8-methyl-2-(6-methylheptyl)-2-(6-methylheptylsulfanyl)nonanoate; phosphorous acid Openeye Name: 8-methyl-2-(6-methylheptyl)-2-(6-methylheptylsulfanyl)nonanoate; phosphorous acid CAS Name: 8-methyl-2-(6-methylheptyl)-2-(6-methylheptylthio)nonanoate; phosphorous acid IUPAC Name: 8-methyl-2-(6-methylheptyl)-2-(6-methylheptylsulfanyl)nonanoate; phosphorous acid Traditional Name: 8-methyl-2-(6-methylheptyl)-2-(6-methylheptylthio)pelargonate; phosphorous acid Formula: C26H54O5PS- MolecularWeight: 509.742721

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])SCCCCCC(C)C.OP(O)O

Isomeric SMILES

CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])SCCCCCC(C)C.OP(O)O

InChI

InChI=1S/C26H52O2S.H3O3P/c1-22(2)16-10-7-13-19-26(25(27)28,20-14-8-11-17-23(3)4)29-21-15-9-12-18-24(5)6;1-4(2)3/h22-24H,7-21H2,1-6H3,(H,27,28);1-3H/p-1