butyl-ethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: butyl-ethyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: butyl-ethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: butyl-ethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: butyl-ethyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C17H26N3+ MolecularWeight: 272.40844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3/c1-4-6-11-20(5-2)13-16-12-18-19-17(16)15-9-7-14(3)8-10-15/h7-10,12H,4-6,11,13H2,1-3H3,(H,18,19)/p+1