1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-(phenylmethyl)piperazin-4-ium

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-(phenylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-[(2,6-difluorophenyl)methyl]piperazin-1-ium CAS Name: 1-[(2,6-difluorophenyl)methyl]-4-(phenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-[(2,6-difluorophenyl)methyl]piperazin-1-ium Traditional Name: 1-benzyl-4-(2,6-difluorobenzyl)piperazin-1-ium Formula: C18H21F2N2+ MolecularWeight: 303.369546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)CC3=C(C=CC=C3F)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)CC3=C(C=CC=C3F)F

InChI

InChI=1S/C18H20F2N2/c19-17-7-4-8-18(20)16(17)14-22-11-9-21(10-12-22)13-15-5-2-1-3-6-15/h1-8H,9-14H2/p+1