O-[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] 2,2-dioctylundecanethioate

Systemtic Name: O-[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] 2,2-dioctylundecanethioate Openeye Name: O-[3-hydroxy-2-(hydroxymethyl)-2-methyl-propyl] 2,2-dioctylundecanethioate CAS Name: 2,2-dioctylundecanethioic acid O-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] ester IUPAC Name: O-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] 2,2-dioctylundecanethioate Traditional Name: 2,2-dioctylundecanethioic acid O-(3-hydroxy-2-methyl-2-methylol-propyl) ester Formula: C32H64O3S MolecularWeight: 528.91376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCC)(CCCCCCCC)C(=S)OCC(C)(CO)CO

Isomeric SMILES

CCCCCCCCCC(CCCCCCCC)(CCCCCCCC)C(=S)OCC(C)(CO)CO

InChI

InChI=1S/C32H64O3S/c1-5-8-11-14-17-20-23-26-32(24-21-18-15-12-9-6-2,25-22-19-16-13-10-7-3)30(36)35-29-31(4,27-33)28-34/h33-34H,5-29H2,1-4H3