methyl 7-(2-octyl-5-oxidanylidene-cyclopentyl)-2-oxidanyl-heptanoate

Systemtic Name: methyl 7-(2-octyl-5-oxidanylidene-cyclopentyl)-2-oxidanyl-heptanoate Openeye Name: methyl 2-hydroxy-7-(2-octyl-5-oxo-cyclopentyl)heptanoate CAS Name: 2-hydroxy-7-(2-octyl-5-oxocyclopentyl)heptanoic acid methyl ester IUPAC Name: methyl 2-hydroxy-7-(2-octyl-5-oxocyclopentyl)heptanoate Traditional Name: 2-hydroxy-7-(2-keto-5-octyl-cyclopentyl)enanthic acid methyl ester Formula: C21H38O4 MolecularWeight: 354.52402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(=O)C1CCCCCC(C(=O)OC)O

Isomeric SMILES

CCCCCCCCC1CCC(=O)C1CCCCCC(C(=O)OC)O

InChI

InChI=1S/C21H38O4/c1-3-4-5-6-7-9-12-17-15-16-19(22)18(17)13-10-8-11-14-20(23)21(24)25-2/h17-18,20,23H,3-16H2,1-2H3