propan-2-yl (E)-9-[3,5-bis(oxidanyl)-2-(3-oxidanylideneoctyl)cyclopentyl]non-7-enoate

Systemtic Name: propan-2-yl (E)-9-[3,5-bis(oxidanyl)-2-(3-oxidanylideneoctyl)cyclopentyl]non-7-enoate Openeye Name: isopropyl (E)-9-[3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]non-7-enoate CAS Name: (E)-9-[3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]-7-nonenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-9-[3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]non-7-enoate Traditional Name: (E)-9-[3,5-dihydroxy-2-(3-ketooctyl)cyclopentyl]non-7-enoic acid isopropyl ester Formula: C25H44O5 MolecularWeight: 424.61386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CCC1C(CC(C1CC=CCCCCCC(=O)OC(C)C)O)O

Isomeric SMILES

CCCCCC(=O)CCC1C(CC(C1C/C=C/CCCCCC(=O)OC(C)C)O)O

InChI

InChI=1S/C25H44O5/c1-4-5-10-13-20(26)16-17-22-21(23(27)18-24(22)28)14-11-8-6-7-9-12-15-25(29)30-19(2)3/h8,11,19,21-24,27-28H,4-7,9-10,12-18H2,1-3H3/b11-8+