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

Systemtic Name: ethyl 4-(2-bromanyl-4-fluoranyl-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 4-(2-bromo-4-fluoro-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-bromo-4-fluorophenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-bromo-4-fluorophenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-bromo-4-fluoro-phenyl)-5-cyano-2-(methoxymethyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C18H18BrFN2O3 MolecularWeight: 409.249523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C(C=C(C=C2)F)Br)C#N)C)COC

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C(C=C(C=C2)F)Br)C#N)C)COC

InChI

InChI=1S/C18H18BrFN2O3/c1-4-25-18(23)17-15(9-24-3)22-10(2)13(8-21)16(17)12-6-5-11(20)7-14(12)19/h5-7,16,22H,4,9H2,1-3H3