ethyl 6-azanyl-5-cyano-2-methyl-1-(4-methylphenyl)-4,4-bis(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-2-methyl-1-(4-methylphenyl)-4,4-bis(trifluoromethyl)pyridine-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-2-methyl-1-(p-tolyl)-4,4-bis(trifluoromethyl)pyridine-3-carboxylate CAS Name: 6-amino-5-cyano-2-methyl-1-(4-methylphenyl)-4,4-bis(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-2-methyl-1-(4-methylphenyl)-4,4-bis(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 6-amino-5-cyano-2-methyl-1-(p-tolyl)-4,4-bis(trifluoromethyl)nicotinic acid ethyl ester Formula: C19H17F6N3O2 MolecularWeight: 433.347599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17F6N3O2/c1-4-30-16(29)14-11(3)28(12-7-5-10(2)6-8-12)15(27)13(9-26)17(14,18(20,21)22)19(23,24)25/h5-8H,4,27H2,1-3H3