1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(2,5-difluorophenyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(2,5-difluorophenyl)methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(2,5-difluorophenyl)methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-(2,5-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(=C2)F)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)F)F

InChI

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