7-[(1R,2S)-2-(3-ethanoyloctyl)-5-oxidanylidene-cyclopentyl]heptanethioic S-acid

Systemtic Name: 7-[(1R,2S)-2-(3-ethanoyloctyl)-5-oxidanylidene-cyclopentyl]heptanethioic S-acid Openeye Name: 7-[(1R,2S)-2-(3-acetyloctyl)-5-oxo-cyclopentyl]heptanethioic S-acid CAS Name: 7-[(1R,2S)-2-(3-acetyloctyl)-5-oxocyclopentyl]heptanethioic S-acid IUPAC Name: 7-[(1R,2S)-2-(3-acetyloctyl)-5-oxocyclopentyl]heptanethioic S-acid Traditional Name: 7-[(1R,2S)-2-(3-acetyloctyl)-5-keto-cyclopentyl]thioenanthic acid Formula: C22H38O3S MolecularWeight: 382.60032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CCC(=O)C1CCCCCCC(=O)S)C(=O)C

Isomeric SMILES

CCCCCC(CC[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)S)C(=O)C

InChI

InChI=1S/C22H38O3S/c1-3-4-7-10-18(17(2)23)13-14-19-15-16-21(24)20(19)11-8-5-6-9-12-22(25)26/h18-20H,3-16H2,1-2H3,(H,25,26)/t18?,19-,20+/m0/s1