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

Systemtic Name: tert-butyl 4-(2-chloranyl-4-fluoranyl-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: tert-butyl 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chloro-4-fluorophenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-chloro-4-fluorophenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid tert-butyl ester Formula: C20H22ClFN2O3 MolecularWeight: 392.851683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClFN2O3/c1-11-14(9-23)17(13-7-6-12(22)8-15(13)21)18(16(24-11)10-26-5)19(25)27-20(2,3)4/h6-8,17,24H,10H2,1-5H3