6-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-phenyl-4-(2-pyridin-4-ylethanoyl)piperazin-2-one

Systemtic Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-phenyl-4-(2-pyridin-4-ylethanoyl)piperazin-2-one Openeye Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-phenyl-4-[2-(4-pyridyl)acetyl]piperazin-2-one CAS Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-(1-oxo-2-pyridin-4-ylethyl)-5-phenyl-2-piperazinone IUPAC Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-phenyl-4-(2-pyridin-4-ylacetyl)piperazin-2-one Traditional Name: 6-[[3,5-bis(trifluoromethyl)benzyl]oxymethyl]-5-phenyl-4-[2-(4-pyridyl)acetyl]piperazin-2-one Formula: C27H23F6N3O3 MolecularWeight: 551.480239

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(C(N1C(=O)CC2=CC=NC=C2)C3=CC=CC=C3)COCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1C(=O)NC(C(N1C(=O)CC2=CC=NC=C2)C3=CC=CC=C3)COCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H23F6N3O3/c28-26(29,30)20-10-18(11-21(13-20)27(31,32)33)15-39-16-22-25(19-4-2-1-3-5-19)36(14-23(37)35-22)24(38)12-17-6-8-34-9-7-17/h1-11,13,22,25H,12,14-16H2,(H,35,37)