2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]phenol

Systemtic Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[[4-(1-pyrazolyl)phenyl]methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-(4-pyrazol-1-ylbenzyl)piperazin-4-ium-1-yl]phenol Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4O

InChI

InChI=1S/C20H22N4O/c25-20-5-2-1-4-19(20)23-14-12-22(13-15-23)16-17-6-8-18(9-7-17)24-11-3-10-21-24/h1-11,25H,12-16H2/p+1