4-methyl-4-octadecylsulfanyl-3-oxidanylidene-pentanoic acid

Systemtic Name: 4-methyl-4-octadecylsulfanyl-3-oxidanylidene-pentanoic acid Openeye Name: 4-methyl-4-octadecylsulfanyl-3-oxo-pentanoic acid CAS Name: 4-methyl-4-(octadecylthio)-3-oxopentanoic acid IUPAC Name: 4-methyl-4-octadecylsulfanyl-3-oxopentanoic acid Traditional Name: 3-keto-4-methyl-4-(stearylthio)valeric acid Formula: C24H46O3S MolecularWeight: 414.68524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC(C)(C)C(=O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC(C)(C)C(=O)CC(=O)O

InChI

InChI=1S/C24H46O3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-24(2,3)22(25)21-23(26)27/h4-21H2,1-3H3,(H,26,27)