(E)-1,1,1-tris(fluoranyl)-4-[4-(phenylmethyl)piperazin-1-yl]but-3-en-2-one

Systemtic Name: (E)-1,1,1-tris(fluoranyl)-4-[4-(phenylmethyl)piperazin-1-yl]but-3-en-2-one Openeye Name: (E)-4-(4-benzylpiperazin-1-yl)-1,1,1-trifluoro-but-3-en-2-one CAS Name: (E)-1,1,1-trifluoro-4-[4-(phenylmethyl)-1-piperazinyl]-3-buten-2-one IUPAC Name: (E)-4-(4-benzylpiperazin-1-yl)-1,1,1-trifluorobut-3-en-2-one Traditional Name: (E)-4-(4-benzylpiperazino)-1,1,1-trifluoro-but-3-en-2-one Formula: C15H17F3N2O MolecularWeight: 298.30349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)/C=C/C(=O)C(F)(F)F

InChI

InChI=1S/C15H17F3N2O/c16-15(17,18)14(21)6-7-19-8-10-20(11-9-19)12-13-4-2-1-3-5-13/h1-7H,8-12H2/b7-6+