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

Systemtic Name: 2,2-dimethylpropyl 4-(2-chloranyl-4-fluoranyl-phenyl)-5-cyano-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Openeye Name: 2,2-dimethylpropyl 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chloro-4-fluorophenyl)-5-cyano-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 4-(2-chloro-4-fluorophenyl)-5-cyano-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-phenyl)-5-cyano-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid neopentyl ester Formula: C20H22ClFN2O2 MolecularWeight: 376.852283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClFN2O2/c1-11-15(9-23)18(14-7-6-13(22)8-16(14)21)17(12(2)24-11)19(25)26-10-20(3,4)5/h6-8,18,24H,10H2,1-5H3