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

Systemtic Name: ethyl 6-[2-[(E)-3-oxidanylideneoct-1-enyl]-5-phenylmethoxy-pyridin-4-yl]oxyhexanoate Openeye Name: ethyl 6-[[5-benzyloxy-2-[(E)-3-oxooct-1-enyl]-4-pyridyl]oxy]hexanoate CAS Name: 6-[[2-[(E)-3-oxooct-1-enyl]-5-phenylmethoxy-4-pyridinyl]oxy]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-[(E)-3-oxooct-1-enyl]-5-phenylmethoxypyridin-4-yl]oxyhexanoate Traditional Name: 6-[[5-benzoxy-2-[(E)-3-ketooct-1-enyl]-4-pyridyl]oxy]hexanoic acid ethyl ester Formula: C28H37NO5 MolecularWeight: 467.59708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C=CC1=NC=C(C(=C1)OCCCCCC(=O)OCC)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)/C=C/C1=NC=C(C(=C1)OCCCCCC(=O)OCC)OCC2=CC=CC=C2

InChI

InChI=1S/C28H37NO5/c1-3-5-8-15-25(30)18-17-24-20-26(33-19-12-7-11-16-28(31)32-4-2)27(21-29-24)34-22-23-13-9-6-10-14-23/h6,9-10,13-14,17-18,20-21H,3-5,7-8,11-12,15-16,19,22H2,1-2H3/b18-17+