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

Systemtic Name: 1-(3-chlorophenyl)-4-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[(1-phenethyltetrazol-5-yl)methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[(1-phenethyl-5-tetrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(1-phenethyltetrazol-5-yl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-[(1-phenethyltetrazol-5-yl)methyl]piperazin-4-ium Formula: C20H24ClN6+ MolecularWeight: 383.89776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NN=NN2CCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=NN=NN2CCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H23ClN6/c21-18-7-4-8-19(15-18)26-13-11-25(12-14-26)16-20-22-23-24-27(20)10-9-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2/p+1