[3-azanyl-2-(phenylmethyl)-1H-pyrazol-2-ium-5-yl]methyl-dimethyl-azanium

Systemtic Name: [3-azanyl-2-(phenylmethyl)-1H-pyrazol-2-ium-5-yl]methyl-dimethyl-azanium Openeye Name: (3-amino-2-benzyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-ammonium CAS Name: [3-amino-2-(phenylmethyl)-1H-pyrazol-2-ium-5-yl]methyl-dimethylammonium IUPAC Name: (3-amino-2-benzyl-1H-pyrazol-2-ium-5-yl)methyl-dimethylazanium Traditional Name: (3-amino-2-benzyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-ammonium Formula: C13H20N4+2 MolecularWeight: 232.3247

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC(=[N+](N1)CC2=CC=CC=C2)N

Isomeric SMILES

C[NH+](C)CC1=CC(=[N+](N1)CC2=CC=CC=C2)N

InChI

InChI=1S/C13H18N4/c1-16(2)10-12-8-13(14)17(15-12)9-11-6-4-3-5-7-11/h3-8H,9-10H2,1-2H3,(H2,14,15)/p+2