4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]aniline

Systemtic Name: 4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]aniline Openeye Name: 4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]aniline CAS Name: 4-[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]aniline IUPAC Name: 4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]aniline Traditional Name: [4-[4-(4-fluorobenzyl)piperazin-4-ium-1-yl]phenyl]amine Formula: C17H21FN3+ MolecularWeight: 286.367143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C3=CC=C(C=C3)N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H20FN3/c18-15-3-1-14(2-4-15)13-20-9-11-21(12-10-20)17-7-5-16(19)6-8-17/h1-8H,9-13,19H2/p+1