4-phenyl-1-piperidin-4-yl-3-[[3-(trifluoromethyloxy)phenyl]methyl]-4H-quinazolin-2-one

Systemtic Name: 4-phenyl-1-piperidin-4-yl-3-[[3-(trifluoromethyloxy)phenyl]methyl]-4H-quinazolin-2-one Openeye Name: 4-phenyl-1-(4-piperidyl)-3-[[3-(trifluoromethoxy)phenyl]methyl]-4H-quinazolin-2-one CAS Name: 4-phenyl-1-(4-piperidinyl)-3-[[3-(trifluoromethoxy)phenyl]methyl]-4H-quinazolin-2-one IUPAC Name: 4-phenyl-1-piperidin-4-yl-3-[[3-(trifluoromethoxy)phenyl]methyl]-4H-quinazolin-2-one Traditional Name: 4-phenyl-1-(4-piperidyl)-3-[3-(trifluoromethoxy)benzyl]-4H-quinazolin-2-one Formula: C27H26F3N3O2 MolecularWeight: 481.50945

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C3=CC=CC=C3C(N(C2=O)CC4=CC(=CC=C4)OC(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1CNCCC1N2C3=CC=CC=C3C(N(C2=O)CC4=CC(=CC=C4)OC(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C27H26F3N3O2/c28-27(29,30)35-22-10-6-7-19(17-22)18-32-25(20-8-2-1-3-9-20)23-11-4-5-12-24(23)33(26(32)34)21-13-15-31-16-14-21/h1-12,17,21,25,31H,13-16,18H2