ethyl 8-[2-[(E)-3-oxidanylhept-1-enyl]-5-oxidanylidene-cyclopentyl]oct-6-ynoate

Systemtic Name: ethyl 8-[2-[(E)-3-oxidanylhept-1-enyl]-5-oxidanylidene-cyclopentyl]oct-6-ynoate Openeye Name: ethyl 8-[2-[(E)-3-hydroxyhept-1-enyl]-5-oxo-cyclopentyl]oct-6-ynoate CAS Name: 8-[2-[(E)-3-hydroxyhept-1-enyl]-5-oxocyclopentyl]-6-octynoic acid ethyl ester IUPAC Name: ethyl 8-[2-[(E)-3-hydroxyhept-1-enyl]-5-oxocyclopentyl]oct-6-ynoate Traditional Name: 8-[2-[(E)-3-hydroxyhept-1-enyl]-5-keto-cyclopentyl]oct-6-ynoic acid ethyl ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=CC1CCC(=O)C1CC#CCCCCC(=O)OCC)O

Isomeric SMILES

CCCCC(/C=C/C1CCC(=O)C1CC#CCCCCC(=O)OCC)O

InChI

InChI=1S/C22H34O4/c1-3-5-11-19(23)16-14-18-15-17-21(24)20(18)12-9-7-6-8-10-13-22(25)26-4-2/h14,16,18-20,23H,3-6,8,10-13,15,17H2,1-2H3/b16-14+