4-[4-[(E)-2-[2-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-yl]ethenyl]phenoxy]butanenitrile

Systemtic Name: 4-[4-[(E)-2-[2-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-yl]ethenyl]phenoxy]butanenitrile Openeye Name: 4-[4-[(E)-2-[2-oxo-6-(trifluoromethyl)-1H-pyrimidin-4-yl]vinyl]phenoxy]butanenitrile CAS Name: 4-[4-[(E)-2-[2-oxo-6-(trifluoromethyl)-1H-pyrimidin-4-yl]ethenyl]phenoxy]butanenitrile IUPAC Name: 4-[4-[(E)-2-[2-oxo-6-(trifluoromethyl)-1H-pyrimidin-4-yl]ethenyl]phenoxy]butanenitrile Traditional Name: 4-[4-[(E)-2-[2-keto-6-(trifluoromethyl)-1H-pyrimidin-4-yl]vinyl]phenoxy]butyronitrile Formula: C17H14F3N3O2 MolecularWeight: 349.30717

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=NC(=O)NC(=C2)C(F)(F)F)OCCCC#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=NC(=O)NC(=C2)C(F)(F)F)OCCCC#N

InChI

InChI=1S/C17H14F3N3O2/c18-17(19,20)15-11-13(22-16(24)23-15)6-3-12-4-7-14(8-5-12)25-10-2-1-9-21/h3-8,11H,1-2,10H2,(H,22,23,24)/b6-3+