butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethyl-azanium

Systemtic Name: butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethyl-azanium Openeye Name: butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethyl-ammonium CAS Name: butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethylammonium IUPAC Name: butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethylazanium Traditional Name: butyl-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-ethyl-ammonium Formula: C18H28N3+ MolecularWeight: 286.43502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3/c1-5-7-10-21(6-2)13-17-12-19-20-18(17)16-9-8-14(3)15(4)11-16/h8-9,11-12H,5-7,10,13H2,1-4H3,(H,19,20)/p+1