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

Systemtic Name: ethyl 6-methyl-4-(2-methylphenyl)-2-oxidanylidene-1-[[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylphenyl]methyl]-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl 6-methyl-4-(o-tolyl)-2-oxo-1-[[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phenyl]methyl]-3,4-dihydropyridine-5-carboxylate CAS Name: 6-methyl-4-(2-methylphenyl)-2-oxo-1-[[4-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]phenyl]methyl]-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-4-(2-methylphenyl)-2-oxo-1-[[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]phenyl]methyl]-3,4-dihydropyridine-5-carboxylate Traditional Name: 2-keto-6-methyl-4-(o-tolyl)-1-[4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]benzyl]-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C35H36F3N3O4 MolecularWeight: 619.67325

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=CC=C2C)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=CC=C2C)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F)C

InChI

InChI=1S/C35H36F3N3O4/c1-4-45-34(44)32-24(3)41(31(42)21-30(32)29-11-6-5-8-23(29)2)22-25-12-14-26(15-13-25)33(43)40-18-16-39(17-19-40)28-10-7-9-27(20-28)35(36,37)38/h5-15,20,30H,4,16-19,21-22H2,1-3H3