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

Systemtic Name: ethyl 1-[[3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]methyl]-4-(4-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl 1-[[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]methyl]-4-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate CAS Name: 1-[[3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-4-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]methyl]-4-(4-fluorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzyl]-4-(4-fluorophenyl)-2-keto-6-methyl-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C33H33ClFN3O4 MolecularWeight: 590.084223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=C(C=C2)F)CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=C(C=C2)F)CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl)C

InChI

InChI=1S/C33H33ClFN3O4/c1-3-42-33(41)31-22(2)38(30(39)20-29(31)24-10-12-27(35)13-11-24)21-23-6-4-7-25(18-23)32(40)37-16-14-36(15-17-37)28-9-5-8-26(34)19-28/h4-13,18-19,29H,3,14-17,20-21H2,1-2H3