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

Systemtic Name: methyl 6-[5-methoxy-2-[(E)-3-oxidanylideneoct-1-enyl]pyridin-4-yl]oxyhexanoate Openeye Name: methyl 6-[[5-methoxy-2-[(E)-3-oxooct-1-enyl]-4-pyridyl]oxy]hexanoate CAS Name: 6-[[5-methoxy-2-[(E)-3-oxooct-1-enyl]-4-pyridinyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[5-methoxy-2-[(E)-3-oxooct-1-enyl]pyridin-4-yl]oxyhexanoate Traditional Name: 6-[[2-[(E)-3-ketooct-1-enyl]-5-methoxy-4-pyridyl]oxy]hexanoic acid methyl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO5/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/h12-13,15-16H,4-11,14H2,1-3H3/b13-12+