N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: N-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [5-(p-tolyl)-1H-pyrazol-4-yl]methyl-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C17H25N4+ MolecularWeight: 285.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)CNCC[NH+]3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)CNCC[NH+]3CCCC3

InChI

InChI=1S/C17H24N4/c1-14-4-6-15(7-5-14)17-16(13-19-20-17)12-18-8-11-21-9-2-3-10-21/h4-7,13,18H,2-3,8-12H2,1H3,(H,19,20)/p+1