5-propylnonylsulfanyl 2-methyl-5-[4-methyl-5-oxidanylidene-5-(5-propylnonylsulfanyloxy)pentyl]sulfanyl-pentanoate

Systemtic Name: 5-propylnonylsulfanyl 2-methyl-5-[4-methyl-5-oxidanylidene-5-(5-propylnonylsulfanyloxy)pentyl]sulfanyl-pentanoate Openeye Name: 5-propylnonylsulfanyl 2-methyl-5-[4-methyl-5-oxo-5-(5-propylnonylsulfanyloxy)pentyl]sulfanyl-pentanoate CAS Name: 2-methyl-5-[[4-methyl-5-oxo-5-(5-propylnonylthio)oxypentyl]thio]pentanoic acid (5-propylnonylthio) ester IUPAC Name: 5-propylnonylsulfanyl 2-methyl-5-[4-methyl-5-oxo-5-(5-propylnonylsulfanyloxy)pentyl]sulfanylpentanoate Traditional Name: 5-[[5-keto-4-methyl-5-(5-propylnonylthio)oxy-pentyl]thio]-2-methyl-valeric acid (5-propylnonylthio) ester Formula: C36H70O4S3 MolecularWeight: 663.1336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)CCCCSOC(=O)C(C)CCCSCCCC(C)C(=O)OSCCCCC(CCC)CCCC

Isomeric SMILES

CCCCC(CCC)CCCCSOC(=O)C(C)CCCSCCCC(C)C(=O)OSCCCCC(CCC)CCCC

InChI

InChI=1S/C36H70O4S3/c1-7-11-23-33(19-9-3)25-13-15-29-42-39-35(37)31(5)21-17-27-41-28-18-22-32(6)36(38)40-43-30-16-14-26-34(20-10-4)24-12-8-2/h31-34H,7-30H2,1-6H3