1-[(4-chlorophenyl)methyl]-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-ium

Systemtic Name: 1-[(4-chlorophenyl)methyl]-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-ium Openeye Name: 1-[(4-chlorophenyl)methyl]-4-(1-phenyltetrazol-5-yl)piperazin-1-ium CAS Name: 1-[(4-chlorophenyl)methyl]-4-(1-phenyl-5-tetrazolyl)piperazin-1-ium IUPAC Name: 1-[(4-chlorophenyl)methyl]-4-(1-phenyltetrazol-5-yl)piperazin-1-ium Traditional Name: 1-(4-chlorobenzyl)-4-(1-phenyltetrazol-5-yl)piperazin-1-ium Formula: C18H20ClN6+ MolecularWeight: 355.8446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H19ClN6/c19-16-8-6-15(7-9-16)14-23-10-12-24(13-11-23)18-20-21-22-25(18)17-4-2-1-3-5-17/h1-9H,10-14H2/p+1