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

Systemtic Name: 1-phenyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-phenyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium CAS Name: 1-phenyl-4-[(1-phenyl-4-pyrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-phenyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-phenyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Formula: C20H23N4+ MolecularWeight: 319.42342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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