1-phenyl-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-phenyl-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperazin-4-ium Openeye Name: 1-phenyl-4-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperazin-4-ium CAS Name: 1-phenyl-4-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]piperazin-4-ium IUPAC Name: 1-phenyl-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperazin-4-ium Traditional Name: 1-phenyl-4-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperazin-4-ium Formula: C20H23N4+ MolecularWeight: 319.42342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CN2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CN2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4/c1-2-6-18(7-3-1)23-14-12-22(13-15-23)17-20-9-5-11-24(20)19-8-4-10-21-16-19/h1-11,16H,12-15,17H2/p+1