ethyl 5,6-bis(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5,6-bis(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)-1H-pyridine-3-carboxylate Openeye Name: ethyl 5,6-bis(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylate CAS Name: 5,6-bis(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-bis(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylate Traditional Name: 5,6-bis(4-chlorophenyl)-4-keto-2-(trifluoromethyl)-1H-pyridine-3-carboxylic acid ethyl ester Formula: C21H14Cl2F3NO3 MolecularWeight: 456.24197

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H14Cl2F3NO3/c1-2-30-20(29)16-18(28)15(11-3-7-13(22)8-4-11)17(27-19(16)21(24,25)26)12-5-9-14(23)10-6-12/h3-10H,2H2,1H3,(H,27,28)