1-(2-chlorophenyl)-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-chlorophenyl)-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-(2-chlorophenyl)-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium CAS Name: 1-(2-chlorophenyl)-4-[(1-phenyl-4-pyrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-chlorophenyl)-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-(2-chlorophenyl)-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Formula: C20H22ClN4+ MolecularWeight: 353.86848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN(N=C2)C3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN(N=C2)C3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

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