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

Systemtic Name: ethyl 6-[4-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]pyran-3-yl]oxyhexanoate Openeye Name: ethyl 6-[2-[(E)-3-hydroxyoct-1-enyl]-4-oxo-pyran-3-yl]oxyhexanoate CAS Name: 6-[[2-[(E)-3-hydroxyoct-1-enyl]-4-oxo-3-pyranyl]oxy]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-[(E)-3-hydroxyoct-1-enyl]-4-oxopyran-3-yl]oxyhexanoate Traditional Name: 6-[2-[(E)-3-hydroxyoct-1-enyl]-4-keto-pyran-3-yl]oxyhexanoic acid ethyl ester Formula: C21H32O6 MolecularWeight: 380.47518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1=C(C(=O)C=CO1)OCCCCCC(=O)OCC)O

Isomeric SMILES

CCCCCC(/C=C/C1=C(C(=O)C=CO1)OCCCCCC(=O)OCC)O

InChI

InChI=1S/C21H32O6/c1-3-5-7-10-17(22)12-13-19-21(18(23)14-16-26-19)27-15-9-6-8-11-20(24)25-4-2/h12-14,16-17,22H,3-11,15H2,1-2H3/b13-12+