6-(diethoxymethyl)-5-ethoxycarbonyl-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-(diethoxymethyl)-5-ethoxycarbonyl-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-(diethoxymethyl)-5-ethoxycarbonyl-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-(diethoxymethyl)-5-ethoxycarbonyl-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-(diethoxymethyl)-5-ethoxycarbonyl-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbethoxy-6-(diethoxymethyl)-2-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Formula: C22H26F3NO6 MolecularWeight: 457.44015

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC=C2C(F)(F)F)C(=O)OCC)OCC

Isomeric SMILES

CCOC(C1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC=C2C(F)(F)F)C(=O)OCC)OCC

InChI

InChI=1S/C22H26F3NO6/c1-5-30-20(29)17-16(13-10-8-9-11-14(13)22(23,24)25)15(19(27)28)12(4)26-18(17)21(31-6-2)32-7-3/h8-11,16,21,26H,5-7H2,1-4H3,(H,27,28)