methyl 7-[3-(4,4-dimethyl-3-oxidanyl-octyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]heptanoate

Systemtic Name: methyl 7-[3-(4,4-dimethyl-3-oxidanyl-octyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]heptanoate Openeye Name: methyl 7-[3-(3-hydroxy-4,4-dimethyl-octyl)-4-oxo-thiazolidin-2-yl]heptanoate CAS Name: 7-[3-(3-hydroxy-4,4-dimethyloctyl)-4-oxo-2-thiazolidinyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[3-(3-hydroxy-4,4-dimethyloctyl)-4-oxo-1,3-thiazolidin-2-yl]heptanoate Traditional Name: 7-[3-(3-hydroxy-4,4-dimethyl-octyl)-4-keto-thiazolidin-2-yl]enanthic acid methyl ester Formula: C21H39NO4S MolecularWeight: 401.60366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CCN1C(SCC1=O)CCCCCCC(=O)OC)O

Isomeric SMILES

CCCCC(C)(C)C(CCN1C(SCC1=O)CCCCCCC(=O)OC)O

InChI

InChI=1S/C21H39NO4S/c1-5-6-14-21(2,3)17(23)13-15-22-18(24)16-27-19(22)11-9-7-8-10-12-20(25)26-4/h17,19,23H,5-16H2,1-4H3