1-(3-chlorophenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[[4-(1-pyrazolyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-(4-pyrazol-1-ylbenzyl)piperazin-4-ium Formula: C20H22ClN4+ MolecularWeight: 353.86848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H21ClN4/c21-18-3-1-4-20(15-18)24-13-11-23(12-14-24)16-17-5-7-19(8-6-17)25-10-2-9-22-25/h1-10,15H,11-14,16H2/p+1