ethyl 5-cyano-6-[(4-methylphenyl)amino]-2-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[(4-methylphenyl)amino]-2-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-(4-methylanilino)-2-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 5-cyano-6-(4-methylanilino)-2-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-(4-methylanilino)-2-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 5-cyano-6-(p-toluidino)-2-(trifluoromethyl)nicotinic acid ethyl ester Formula: C17H14F3N3O2 MolecularWeight: 349.30717

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)NC2=CC=C(C=C2)C)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)NC2=CC=C(C=C2)C)C(F)(F)F

InChI

InChI=1S/C17H14F3N3O2/c1-3-25-16(24)13-8-11(9-21)15(23-14(13)17(18,19)20)22-12-6-4-10(2)5-7-12/h4-8H,3H2,1-2H3,(H,22,23)