1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-(4-methylphenyl)piperazin-1-ium

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-(4-methylphenyl)piperazin-1-ium Openeye Name: 1-[(2,5-difluorophenyl)methyl]-4-(p-tolyl)piperazin-1-ium CAS Name: 1-[(2,5-difluorophenyl)methyl]-4-(4-methylphenyl)piperazin-1-ium IUPAC Name: 1-[(2,5-difluorophenyl)methyl]-4-(4-methylphenyl)piperazin-1-ium Traditional Name: 1-(2,5-difluorobenzyl)-4-(p-tolyl)piperazin-1-ium Formula: C18H21F2N2+ MolecularWeight: 303.369546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H20F2N2/c1-14-2-5-17(6-3-14)22-10-8-21(9-11-22)13-15-12-16(19)4-7-18(15)20/h2-7,12H,8-11,13H2,1H3/p+1