butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethyl-azanium

Systemtic Name: butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethyl-azanium Openeye Name: butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethyl-ammonium CAS Name: butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethylammonium IUPAC Name: butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethylazanium Traditional Name: butyl-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]-ethyl-ammonium Formula: C16H22Cl2N3+ MolecularWeight: 327.27198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=C(NN=C1)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCC[NH+](CC)CC1=C(NN=C1)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H21Cl2N3/c1-3-5-8-21(4-2)11-12-10-19-20-16(12)14-7-6-13(17)9-15(14)18/h6-7,9-10H,3-5,8,11H2,1-2H3,(H,19,20)/p+1