1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Openeye Name: 1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium CAS Name: 1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium IUPAC Name: 1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Traditional Name: 1-(2-methoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=NN2)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=NN2)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C22H26N4O2/c1-27-19-9-7-17(8-10-19)22-18(15-23-24-22)16-25-11-13-26(14-12-25)20-5-3-4-6-21(20)28-2/h3-10,15H,11-14,16H2,1-2H3,(H,23,24)/p+1