ethyl 6-[6-methyl-4-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]pyran-3-yl]oxyhexanoate

Systemtic Name: ethyl 6-[6-methyl-4-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]pyran-3-yl]oxyhexanoate Openeye Name: ethyl 6-[2-[(E)-3-hydroxyoct-1-enyl]-6-methyl-4-oxo-pyran-3-yl]oxyhexanoate CAS Name: 6-[[2-[(E)-3-hydroxyoct-1-enyl]-6-methyl-4-oxo-3-pyranyl]oxy]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-[(E)-3-hydroxyoct-1-enyl]-6-methyl-4-oxopyran-3-yl]oxyhexanoate Traditional Name: 6-[2-[(E)-3-hydroxyoct-1-enyl]-4-keto-6-methyl-pyran-3-yl]oxyhexanoic acid ethyl ester Formula: C22H34O6 MolecularWeight: 394.50176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1=C(C(=O)C=C(O1)C)OCCCCCC(=O)OCC)O

Isomeric SMILES

CCCCCC(/C=C/C1=C(C(=O)C=C(O1)C)OCCCCCC(=O)OCC)O

InChI

InChI=1S/C22H34O6/c1-4-6-8-11-18(23)13-14-20-22(19(24)16-17(3)28-20)27-15-10-7-9-12-21(25)26-5-2/h13-14,16,18,23H,4-12,15H2,1-3H3/b14-13+