2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-[3-(trifluoromethyl)benzyl]piperazino]cyclohepta-2,4,6-trien-1-one Formula: C19H19F3N2O MolecularWeight: 348.36217

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=CC3=O

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=CC3=O

InChI

InChI=1S/C19H19F3N2O/c20-19(21,22)16-6-4-5-15(13-16)14-23-9-11-24(12-10-23)17-7-2-1-3-8-18(17)25/h1-8,13H,9-12,14H2