2-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline

Systemtic Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Openeye Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline CAS Name: 2-[(4-phenyl-1-piperazin-1-iumyl)methyl]aniline IUPAC Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Traditional Name: [2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]amine Formula: C17H22N3+ MolecularWeight: 268.37668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2N)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3/c18-17-9-5-4-6-15(17)14-19-10-12-20(13-11-19)16-7-2-1-3-8-16/h1-9H,10-14,18H2/p+1