3-[2-[3-(2-oxidanylidene-2-sulfanyl-ethyl)pentadecoxy]ethyl]pentadecanethioic S-acid

Systemtic Name: 3-[2-[3-(2-oxidanylidene-2-sulfanyl-ethyl)pentadecoxy]ethyl]pentadecanethioic S-acid Openeye Name: 3-[2-[3-(2-oxo-2-sulfanyl-ethyl)pentadecoxy]ethyl]pentadecanethioic S-acid CAS Name: 3-[2-[3-(2-mercapto-2-oxoethyl)pentadecoxy]ethyl]pentadecanethioic S-acid IUPAC Name: 3-[2-[3-(2-oxo-2-sulfanylethyl)pentadecoxy]ethyl]pentadecanethioic S-acid Traditional Name: 3-[2-[3-(2-keto-2-mercapto-ethyl)pentadecoxy]ethyl]pentadecanethioic S-acid Formula: C34H66O3S2 MolecularWeight: 587.01604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCOCCC(CCCCCCCCCCCC)CC(=O)S)CC(=O)S

Isomeric SMILES

CCCCCCCCCCCCC(CCOCCC(CCCCCCCCCCCC)CC(=O)S)CC(=O)S

InChI

InChI=1S/C34H66O3S2/c1-3-5-7-9-11-13-15-17-19-21-23-31(29-33(35)38)25-27-37-28-26-32(30-34(36)39)24-22-20-18-16-14-12-10-8-6-4-2/h31-32H,3-30H2,1-2H3,(H,35,38)(H,36,39)