[C-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]carbonimidoyl]azanium chloride

Systemtic Name: [C-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]carbonimidoyl]azanium chloride Openeye Name: (4-benzyl-3,5-dimethyl-pyrazole-1-carboximidoyl)ammonium chloride CAS Name: [[3,5-dimethyl-4-(phenylmethyl)-1-pyrazolyl]-iminomethyl]ammonium chloride IUPAC Name: (4-benzyl-3,5-dimethylpyrazole-1-carboximidoyl)azanium chloride Traditional Name: (4-benzyl-3,5-dimethyl-pyrazole-1-carboximidoyl)ammonium chloride Formula: C13H17ClN4 MolecularWeight: 264.75388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=N)[NH3+])C)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1=C(C(=NN1C(=N)[NH3+])C)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C13H16N4.ClH/c1-9-12(8-11-6-4-3-5-7-11)10(2)17(16-9)13(14)15;/h3-7H,8H2,1-2H3,(H3,14,15);1H