2-methyl-2-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-icosanoic acid

Systemtic Name: 2-methyl-2-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-icosanoic acid Openeye Name: 2-(2-hydroxy-1-methyl-2-oxo-ethyl)sulfanyl-2-methyl-icosanoic acid CAS Name: 2-[(1-hydroxy-1-oxopropan-2-yl)thio]-2-methyleicosanoic acid IUPAC Name: 2-(1-hydroxy-1-oxopropan-2-yl)sulfanyl-2-methylicosanoic acid Traditional Name: 2-[(2-hydroxy-2-keto-1-methyl-ethyl)thio]-2-methyl-arachidic acid Formula: C24H46O4S MolecularWeight: 430.68464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C)(C(=O)O)SC(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C)(C(=O)O)SC(C)C(=O)O

InChI

InChI=1S/C24H46O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(3,23(27)28)29-21(2)22(25)26/h21H,4-20H2,1-3H3,(H,25,26)(H,27,28)