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

Systemtic Name: 1-(4-methoxyphenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(4-methoxyphenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium CAS Name: 1-(4-methoxyphenyl)-4-[[4-(1-pyrazolyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-(4-methoxyphenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-methoxyphenyl)-4-(4-pyrazol-1-ylbenzyl)piperazin-4-ium Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H24N4O/c1-26-21-9-7-19(8-10-21)24-15-13-23(14-16-24)17-18-3-5-20(6-4-18)25-12-2-11-22-25/h2-12H,13-17H2,1H3/p+1