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

Systemtic Name: methyl 4-(2-chloranyl-4-fluoranyl-phenyl)-5-cyano-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chloro-4-fluorophenyl)-5-cyano-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-fluorophenyl)-5-cyano-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C21H16ClFN2O2 MolecularWeight: 382.815343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C#N)C3=C(C=C(C=C3)F)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C#N)C3=C(C=C(C=C3)F)Cl)C(=O)OC

InChI

InChI=1S/C21H16ClFN2O2/c1-12-18(21(26)27-2)19(15-9-8-14(23)10-17(15)22)16(11-24)20(25-12)13-6-4-3-5-7-13/h3-10,19,25H,1-2H3