butyl 3-oxidanylidene-4-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]pentanoate

Systemtic Name: butyl 3-oxidanylidene-4-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]pentanoate Openeye Name: butyl 3-oxo-4-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]pentanoate CAS Name: 3-oxo-4-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]pentanoic acid butyl ester IUPAC Name: butyl 3-oxo-4-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]pentanoate Traditional Name: 3-keto-4-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]valeric acid butyl ester Formula: C21H22F3NO5 MolecularWeight: 425.39829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(=O)C(C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCOC(=O)CC(=O)C(C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C21H22F3NO5/c1-3-4-11-28-20(27)12-18(26)14(2)29-16-6-8-17(9-7-16)30-19-10-5-15(13-25-19)21(22,23)24/h5-10,13-14H,3-4,11-12H2,1-2H3