1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperidin-1-ium CAS Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methylpiperidin-1-ium Traditional Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-4-methyl-piperidin-1-ium Formula: C16H20Cl2N3+ MolecularWeight: 325.2561

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H19Cl2N3/c1-11-4-6-21(7-5-11)10-12-9-19-20-16(12)14-3-2-13(17)8-15(14)18/h2-3,8-9,11H,4-7,10H2,1H3,(H,19,20)/p+1