1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium Formula: C16H24N4O+2 MolecularWeight: 288.38796

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=C(NN=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=C(NN=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H22N4O/c1-19-7-9-20(10-8-19)12-14-11-17-18-16(14)13-3-5-15(21-2)6-4-13/h3-6,11H,7-10,12H2,1-2H3,(H,17,18)/p+2