(3-azanyl-2-methyl-4-phenyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-azanium

Systemtic Name: (3-azanyl-2-methyl-4-phenyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-azanium Openeye Name: (3-amino-2-methyl-4-phenyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-ammonium CAS Name: (3-amino-2-methyl-4-phenyl-1H-pyrazol-2-ium-5-yl)methyl-dimethylammonium IUPAC Name: (3-amino-2-methyl-4-phenyl-1H-pyrazol-2-ium-5-yl)methyl-dimethylazanium Traditional Name: (3-amino-2-methyl-4-phenyl-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[N+]1=C(C(=C(N1)C[NH+](C)C)C2=CC=CC=C2)N

Isomeric SMILES

C[N+]1=C(C(=C(N1)C[NH+](C)C)C2=CC=CC=C2)N

InChI

InChI=1S/C13H18N4/c1-16(2)9-11-12(13(14)17(3)15-11)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H2,14,15)/p+2