1-(1-methylpiperidin-1-ium-4-yl)-4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium CAS Name: 1-(1-methyl-4-piperidin-1-iumyl)-4-[[5-(1-naphthalenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium IUPAC Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium Formula: C24H33N5+2 MolecularWeight: 391.55232

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C[NH+]1CCC(CC1)N2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H31N5/c1-27-11-9-21(10-12-27)29-15-13-28(14-16-29)18-20-17-25-26-24(20)23-8-4-6-19-5-2-3-7-22(19)23/h2-8,17,21H,9-16,18H2,1H3,(H,25,26)/p+2