4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile Openeye Name: 4-[2,4-dioxo-6-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxy-benzonitrile CAS Name: 4-[2,4-dioxo-6-(trifluoromethyl)-1-pyrimidinyl]-5-fluoro-2-methoxybenzonitrile IUPAC Name: 4-[2,4-dioxo-6-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxybenzonitrile Traditional Name: 4-[2,4-diketo-6-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxy-benzonitrile Formula: C13H7F4N3O3 MolecularWeight: 329.206593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C#N)F)N2C(=CC(=O)NC2=O)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1C#N)F)N2C(=CC(=O)NC2=O)C(F)(F)F

InChI

InChI=1S/C13H7F4N3O3/c1-23-9-3-8(7(14)2-6(9)5-18)20-10(13(15,16)17)4-11(21)19-12(20)22/h2-4H,1H3,(H,19,21,22)