propan-2-yl 9-[3,5-bis(oxidanyl)-2-(3-oxidanylidenedecyl)cyclopentyl]nonanoate

Systemtic Name: propan-2-yl 9-[3,5-bis(oxidanyl)-2-(3-oxidanylidenedecyl)cyclopentyl]nonanoate Openeye Name: isopropyl 9-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]nonanoate CAS Name: 9-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]nonanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 9-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]nonanoate Traditional Name: 9-[3,5-dihydroxy-2-(3-ketodecyl)cyclopentyl]pelargonic acid isopropyl ester Formula: C27H50O5 MolecularWeight: 454.6829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CCC1C(CC(C1CCCCCCCCC(=O)OC(C)C)O)O

Isomeric SMILES

CCCCCCCC(=O)CCC1C(CC(C1CCCCCCCCC(=O)OC(C)C)O)O

InChI

InChI=1S/C27H50O5/c1-4-5-6-9-12-15-22(28)18-19-24-23(25(29)20-26(24)30)16-13-10-7-8-11-14-17-27(31)32-21(2)3/h21,23-26,29-30H,4-20H2,1-3H3