2-methyl-5-[4-methyl-5-oxidanyl-5-oxidanylidene-3-(5-propylnonylsulfanyl)pentoxy]-3-(5-propylnonylsulfanyl)pentanoic acid

Systemtic Name: 2-methyl-5-[4-methyl-5-oxidanyl-5-oxidanylidene-3-(5-propylnonylsulfanyl)pentoxy]-3-(5-propylnonylsulfanyl)pentanoic acid Openeye Name: 5-[5-hydroxy-4-methyl-5-oxo-3-(5-propylnonylsulfanyl)pentoxy]-2-methyl-3-(5-propylnonylsulfanyl)pentanoic acid CAS Name: 5-[5-hydroxy-4-methyl-5-oxo-3-(5-propylnonylthio)pentoxy]-2-methyl-3-(5-propylnonylthio)pentanoic acid IUPAC Name: 5-[5-hydroxy-4-methyl-5-oxo-3-(5-propylnonylsulfanyl)pentoxy]-2-methyl-3-(5-propylnonylsulfanyl)pentanoic acid Traditional Name: 5-[5-hydroxy-5-keto-4-methyl-3-(5-propylnonylthio)pentoxy]-2-methyl-3-(5-propylnonylthio)valeric acid Formula: C36H70O5S2 MolecularWeight: 647.068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)CCCCSC(CCOCCC(C(C)C(=O)O)SCCCCC(CCC)CCCC)C(C)C(=O)O

Isomeric SMILES

CCCCC(CCC)CCCCSC(CCOCCC(C(C)C(=O)O)SCCCCC(CCC)CCCC)C(C)C(=O)O

InChI

InChI=1S/C36H70O5S2/c1-7-11-19-31(17-9-3)21-13-15-27-42-33(29(5)35(37)38)23-25-41-26-24-34(30(6)36(39)40)43-28-16-14-22-32(18-10-4)20-12-8-2/h29-34H,7-28H2,1-6H3,(H,37,38)(H,39,40)