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

Systemtic Name: [3-azanyl-4-(3-chlorophenyl)-2-methyl-1H-pyrazol-2-ium-5-yl]methyl-dimethyl-azanium Openeye Name: [3-amino-4-(3-chlorophenyl)-2-methyl-1H-pyrazol-2-ium-5-yl]methyl-dimethyl-ammonium CAS Name: [3-amino-4-(3-chlorophenyl)-2-methyl-1H-pyrazol-2-ium-5-yl]methyl-dimethylammonium IUPAC Name: [3-amino-4-(3-chlorophenyl)-2-methyl-1H-pyrazol-2-ium-5-yl]methyl-dimethylazanium Traditional Name: [3-amino-4-(3-chlorophenyl)-2-methyl-1H-pyrazol-2-ium-5-yl]methyl-dimethyl-ammonium Formula: C13H19ClN4+2 MolecularWeight: 266.76976

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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)Cl)N

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClN4/c1-17(2)8-11-12(13(15)18(3)16-11)9-5-4-6-10(14)7-9/h4-7H,8H2,1-3H3,(H2,15,16)/p+2