methyl 6-[5-methoxy-2-[(E)-3-oxidanyloct-1-enyl]pyridin-4-yl]oxyhexanoate

Systemtic Name: methyl 6-[5-methoxy-2-[(E)-3-oxidanyloct-1-enyl]pyridin-4-yl]oxyhexanoate Openeye Name: methyl 6-[[2-[(E)-3-hydroxyoct-1-enyl]-5-methoxy-4-pyridyl]oxy]hexanoate CAS Name: 6-[[2-[(E)-3-hydroxyoct-1-enyl]-5-methoxy-4-pyridinyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[2-[(E)-3-hydroxyoct-1-enyl]-5-methoxypyridin-4-yl]oxyhexanoate Traditional Name: 6-[[2-[(E)-3-hydroxyoct-1-enyl]-5-methoxy-4-pyridyl]oxy]hexanoic acid methyl ester Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1=NC=C(C(=C1)OCCCCCC(=O)OC)OC)O

Isomeric SMILES

CCCCCC(/C=C/C1=NC=C(C(=C1)OCCCCCC(=O)OC)OC)O

InChI

InChI=1S/C21H33NO5/c1-4-5-7-10-18(23)13-12-17-15-19(20(25-2)16-22-17)27-14-9-6-8-11-21(24)26-3/h12-13,15-16,18,23H,4-11,14H2,1-3H3/b13-12+