O3-(2-cyanoethyl) O5-ethyl 2-(4-fluorophenyl)-6-methyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-cyanoethyl) O5-ethyl 2-(4-fluorophenyl)-6-methyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-cyanoethyl) O5-ethyl 2-(4-fluorophenyl)-4-isopropyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(4-fluorophenyl)-6-methyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-cyanoethyl) ester O5-ethyl ester IUPAC Name: 3-O-(2-cyanoethyl) 5-O-ethyl 2-(4-fluorophenyl)-6-methyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(4-fluorophenyl)-4-isopropyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-cyanoethyl) ester O5-ethyl ester Formula: C22H25FN2O4 MolecularWeight: 400.443303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C(C)C)C(=O)OCCC#N)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C(C)C)C(=O)OCCC#N)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C22H25FN2O4/c1-5-28-21(26)18-14(4)25-20(15-7-9-16(23)10-8-15)19(17(18)13(2)3)22(27)29-12-6-11-24/h7-10,13,17,25H,5-6,12H2,1-4H3