[4-(2-oxidanyl-3-pyrazol-1-yl-propyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(2-oxidanyl-3-pyrazol-1-yl-propyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(2-hydroxy-3-pyrazol-1-yl-propyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone CAS Name: [4-[2-hydroxy-3-(1-pyrazolyl)propyl]-1-piperazinyl]-[2-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(2-hydroxy-3-pyrazol-1-ylpropyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Traditional Name: [4-(2-hydroxy-3-pyrazol-1-yl-propyl)piperazino]-[2-(trifluoromethyl)phenyl]methanone Formula: C18H21F3N4O2 MolecularWeight: 382.38015

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CN2C=CC=N2)O)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(CN2C=CC=N2)O)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H21F3N4O2/c19-18(20,21)16-5-2-1-4-15(16)17(27)24-10-8-23(9-11-24)12-14(26)13-25-7-3-6-22-25/h1-7,14,26H,8-13H2