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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)F)C(=O)OCCC#N)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)F)C(=O)OCCC#N)C)C(C)C

InChI

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