4,4,4-tris(fluoranyl)-2-methyl-1-phenyl-3-[4-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4,4,4-tris(fluoranyl)-2-methyl-1-phenyl-3-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 3-(4-benzylpiperazin-1-yl)-4,4,4-trifluoro-2-methyl-1-phenyl-butan-1-one CAS Name: 4,4,4-trifluoro-2-methyl-1-phenyl-3-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 3-(4-benzylpiperazin-1-yl)-4,4,4-trifluoro-2-methyl-1-phenylbutan-1-one Traditional Name: 3-(4-benzylpiperazino)-4,4,4-trifluoro-2-methyl-1-phenyl-butan-1-one Formula: C22H25F3N2O MolecularWeight: 390.44191

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(F)(F)F)N1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(C(F)(F)F)N1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25F3N2O/c1-17(20(28)19-10-6-3-7-11-19)21(22(23,24)25)27-14-12-26(13-15-27)16-18-8-4-2-5-9-18/h2-11,17,21H,12-16H2,1H3