2-methyl-2-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-3-pentyl-pentadecanoic acid

Systemtic Name: 2-methyl-2-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-3-pentyl-pentadecanoic acid Openeye Name: 2-(2-hydroxy-1-methyl-2-oxo-ethyl)sulfanyl-2-methyl-3-pentyl-pentadecanoic acid CAS Name: 2-[(1-hydroxy-1-oxopropan-2-yl)thio]-2-methyl-3-pentylpentadecanoic acid IUPAC Name: 2-(1-hydroxy-1-oxopropan-2-yl)sulfanyl-2-methyl-3-pentylpentadecanoic acid Traditional Name: 3-amyl-2-[(2-hydroxy-2-keto-1-methyl-ethyl)thio]-2-methyl-pentadecanoic acid Formula: C24H46O4S MolecularWeight: 430.68464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCC)C(C)(C(=O)O)SC(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(CCCCC)C(C)(C(=O)O)SC(C)C(=O)O

InChI

InChI=1S/C24H46O4S/c1-5-7-9-10-11-12-13-14-15-17-19-21(18-16-8-6-2)24(4,23(27)28)29-20(3)22(25)26/h20-21H,5-19H2,1-4H3,(H,25,26)(H,27,28)