1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(2,6-difluorophenyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(2,6-difluorophenyl)methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(2,6-difluorophenyl)methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-(2,6-difluorobenzyl)-4-methyl-piperazine-1,4-diium Formula: C12H18F2N2+2 MolecularWeight: 228.281526

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=C(C=CC=C2F)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C12H16F2N2/c1-15-5-7-16(8-6-15)9-10-11(13)3-2-4-12(10)14/h2-4H,5-9H2,1H3/p+2