2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-pyridin-4-yl-piperazin-1-ium

Systemtic Name: 2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-pyridin-4-yl-piperazin-1-ium Openeye Name: 2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-(4-pyridyl)piperazin-1-ium CAS Name: 2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-pyridin-4-ylpiperazin-1-ium IUPAC Name: 2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-pyridin-4-ylpiperazin-1-ium Traditional Name: 2-(3-chlorophenyl)-1-methyl-4-(1H-pyrazol-5-yl)-1-(4-pyridyl)piperazin-1-ium Formula: C19H21ClN5+ MolecularWeight: 354.85654

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1C2=CC(=CC=C2)Cl)C3=CC=NN3)C4=CC=NC=C4

Isomeric SMILES

C[N+]1(CCN(CC1C2=CC(=CC=C2)Cl)C3=CC=NN3)C4=CC=NC=C4

InChI

InChI=1S/C19H21ClN5/c1-25(17-5-8-21-9-6-17)12-11-24(19-7-10-22-23-19)14-18(25)15-3-2-4-16(20)13-15/h2-10,13,18H,11-12,14H2,1H3,(H,22,23)/q+1