(4-methylpiperazin-4-ium-1-yl)-[2,3,4-tris(fluoranyl)phenyl]methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-[2,3,4-tris(fluoranyl)phenyl]methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-(2,3,4-trifluorophenyl)methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-(2,3,4-trifluorophenyl)methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(2,3,4-trifluorophenyl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-(2,3,4-trifluorophenyl)methanone Formula: C12H14F3N2O+ MolecularWeight: 259.24757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C12H13F3N2O/c1-16-4-6-17(7-5-16)12(18)8-2-3-9(13)11(15)10(8)14/h2-3H,4-7H2,1H3/p+1