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

Systemtic Name: 1-(2-ethoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Openeye Name: 1-(2-ethoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium CAS Name: 1-(2-ethoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Traditional Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-o-phenetyl-piperazin-1-ium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H28N4O2/c1-3-29-22-7-5-4-6-21(22)27-14-12-26(13-15-27)17-19-16-24-25-23(19)18-8-10-20(28-2)11-9-18/h4-11,16H,3,12-15,17H2,1-2H3,(H,24,25)/p+1