4-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]butan-1-one Openeye Name: 4-phenoxy-1-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-4-phenoxy-1-butanone IUPAC Name: 4-phenoxy-1-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]butan-1-one Traditional Name: 4-phenoxy-1-[4-[3-(trifluoromethyl)benzoyl]piperazino]butan-1-one Formula: C22H23F3N2O3 MolecularWeight: 420.42483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCOC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCCOC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O3/c23-22(24,25)18-7-4-6-17(16-18)21(29)27-13-11-26(12-14-27)20(28)10-5-15-30-19-8-2-1-3-9-19/h1-4,6-9,16H,5,10-15H2