ethyl 5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-(2-ethoxy-2-oxo-ethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2-(2-ethoxy-2-oxoethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-(2-ethoxy-2-oxoethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-2-(2-ethoxy-2-keto-ethyl)-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C21H21F3N2O4 MolecularWeight: 422.39765

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(C(=C(N1)C)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(C(=C(N1)C)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C21H21F3N2O4/c1-4-29-17(27)10-16-19(20(28)30-5-2)18(14(11-25)12(3)26-16)13-8-6-7-9-15(13)21(22,23)24/h6-9,18,26H,4-5,10H2,1-3H3