ethyl 7-[3-oxidanyl-5-oxidanylidene-2-[(1E,6E)-4-oxidanylnona-1,6-dienyl]cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[3-oxidanyl-5-oxidanylidene-2-[(1E,6E)-4-oxidanylnona-1,6-dienyl]cyclopentyl]heptanoate Openeye Name: ethyl 7-[3-hydroxy-2-[(1E,6E)-4-hydroxynona-1,6-dienyl]-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[3-hydroxy-2-[(1E,6E)-4-hydroxynona-1,6-dienyl]-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[3-hydroxy-2-[(1E,6E)-4-hydroxynona-1,6-dienyl]-5-oxocyclopentyl]heptanoate Traditional Name: 7-[3-hydroxy-2-[(1E,6E)-4-hydroxynona-1,6-dienyl]-5-keto-cyclopentyl]enanthic acid ethyl ester Formula: C23H38O5 MolecularWeight: 394.54482

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(CC=CC1C(CC(=O)C1CCCCCCC(=O)OCC)O)O

Isomeric SMILES

CC/C=C/CC(C/C=C/C1C(CC(=O)C1CCCCCCC(=O)OCC)O)O

InChI

InChI=1S/C23H38O5/c1-3-5-8-12-18(24)13-11-15-20-19(21(25)17-22(20)26)14-9-6-7-10-16-23(27)28-4-2/h5,8,11,15,18-20,22,24,26H,3-4,6-7,9-10,12-14,16-17H2,1-2H3/b8-5+,15-11+