1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-pyridin-1-ium-2-yl-piperazine Formula: C19H22N5+ MolecularWeight: 320.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(NN=C2)C3=CC=CC=C3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CCN1CC2=C(NN=C2)C3=CC=CC=C3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H21N5/c1-2-6-16(7-3-1)19-17(14-21-22-19)15-23-10-12-24(13-11-23)18-8-4-5-9-20-18/h1-9,14H,10-13,15H2,(H,21,22)/p+1