ethyl 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate

Systemtic Name: ethyl 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate CAS Name: 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-chlorophenyl)methyl]-4-(3-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-(3-chlorobenzyl)-4-(3-fluorophenyl)-2-keto-6-methyl-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C22H21ClFNO3 MolecularWeight: 401.858443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)CC1C2=CC(=CC=C2)F)CC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)CC1C2=CC(=CC=C2)F)CC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C22H21ClFNO3/c1-3-28-22(27)21-14(2)25(13-15-6-4-8-17(23)10-15)20(26)12-19(21)16-7-5-9-18(24)11-16/h4-11,19H,3,12-13H2,1-2H3