5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: 5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate IUPAC Name: 5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Formula: C16H12F3N2O2- MolecularWeight: 321.27389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)[O-])C2=CC=CC=C2C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)[O-])C2=CC=CC=C2C(F)(F)F)C#N

InChI

InChI=1S/C16H13F3N2O2/c1-8-11(7-20)14(13(15(22)23)9(2)21-8)10-5-3-4-6-12(10)16(17,18)19/h3-6,14,21H,1-2H3,(H,22,23)/p-1