5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

Systemtic Name: 5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile Openeye Name: 5-(2-hydroxy-5-methoxy-benzoyl)-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile CAS Name: 5-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 5-(2-hydroxy-5-methoxybenzoyl)-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile Traditional Name: 5-(2-hydroxy-5-methoxy-benzoyl)-2-keto-1-[3-(trifluoromethyl)phenyl]nicotinonitrile Formula: C21H13F3N2O4 MolecularWeight: 414.33413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H13F3N2O4/c1-30-16-5-6-18(27)17(9-16)19(28)13-7-12(10-25)20(29)26(11-13)15-4-2-3-14(8-15)21(22,23)24/h2-9,11,27H,1H3