methyl 7-[2-oxidanyl-5-(3-sulfanyloctyl)cyclopentyl]heptanoate

Systemtic Name: methyl 7-[2-oxidanyl-5-(3-sulfanyloctyl)cyclopentyl]heptanoate Openeye Name: methyl 7-[2-hydroxy-5-(3-sulfanyloctyl)cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-(3-mercaptooctyl)cyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[2-hydroxy-5-(3-sulfanyloctyl)cyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-(3-mercaptooctyl)cyclopentyl]enanthic acid methyl ester Formula: C21H40O3S MolecularWeight: 372.6055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40O3S/c1-3-4-7-10-18(25)15-13-17-14-16-20(22)19(17)11-8-5-6-9-12-21(23)24-2/h17-20,22,25H,3-16H2,1-2H3