ethyl (7E,11E)-7,11-dimethyl-13-(oxan-2-yloxy)-4-oxidanyl-trideca-7,11-dien-2-ynoate

Systemtic Name: ethyl (7E,11E)-7,11-dimethyl-13-(oxan-2-yloxy)-4-oxidanyl-trideca-7,11-dien-2-ynoate Openeye Name: ethyl (7E,11E)-4-hydroxy-7,11-dimethyl-13-tetrahydropyran-2-yloxy-trideca-7,11-dien-2-ynoate CAS Name: (7E,11E)-4-hydroxy-7,11-dimethyl-13-(2-oxanyloxy)trideca-7,11-dien-2-ynoic acid ethyl ester IUPAC Name: ethyl (7E,11E)-4-hydroxy-7,11-dimethyl-13-(oxan-2-yloxy)trideca-7,11-dien-2-ynoate Traditional Name: (7E,11E)-4-hydroxy-7,11-dimethyl-13-tetrahydropyran-2-yloxy-trideca-7,11-dien-2-ynoic acid ethyl ester Formula: C22H34O5 MolecularWeight: 378.50236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC(CCC(=CCCC(=CCOC1CCCCO1)C)C)O

Isomeric SMILES

CCOC(=O)C#CC(CC/C(=C/CC/C(=C/COC1CCCCO1)/C)/C)O

InChI

InChI=1S/C22H34O5/c1-4-25-21(24)14-13-20(23)12-11-18(2)8-7-9-19(3)15-17-27-22-10-5-6-16-26-22/h8,15,20,22-23H,4-7,9-12,16-17H2,1-3H3/b18-8+,19-15+