methyl 2-(3-acetyloxypropyl)-4-(2-chloranyl-4-fluoranyl-phenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 2-(3-acetyloxypropyl)-4-(2-chloranyl-4-fluoranyl-phenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 2-(3-acetoxypropyl)-4-(2-chloro-4-fluoro-phenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 2-(3-acetyloxypropyl)-4-(2-chloro-4-fluorophenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-acetyloxypropyl)-4-(2-chloro-4-fluorophenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-(3-acetoxypropyl)-4-(2-chloro-4-fluoro-phenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C20H20ClFN2O4 MolecularWeight: 406.835203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CCCOC(=O)C)C(=O)OC)C2=C(C=C(C=C2)F)Cl)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)CCCOC(=O)C)C(=O)OC)C2=C(C=C(C=C2)F)Cl)C#N

InChI

InChI=1S/C20H20ClFN2O4/c1-11-15(10-23)18(14-7-6-13(22)9-16(14)21)19(20(26)27-3)17(24-11)5-4-8-28-12(2)25/h6-7,9,18,24H,4-5,8H2,1-3H3