1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperazine-1,4-diium Formula: C15H20Cl2N4+2 MolecularWeight: 327.2521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18Cl2N4/c1-20-4-6-21(7-5-20)10-11-9-18-19-15(11)13-3-2-12(16)8-14(13)17/h2-3,8-9H,4-7,10H2,1H3,(H,18,19)/p+2