1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide

Systemtic Name: 1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide Openeye Name: 1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide CAS Name: 1-[5-[(3,5-dimethyl-1-pyrazolyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide IUPAC Name: 1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide Traditional Name: 1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium bromide Formula: C14H16BrN5 MolecularWeight: 334.21434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC(=NN2)[N+]3=CC=CC=C3)C.[Br-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC(=NN2)[N+]3=CC=CC=C3)C.[Br-]

InChI

InChI=1S/C14H16N5.BrH/c1-11-8-12(2)19(17-11)10-13-9-14(16-15-13)18-6-4-3-5-7-18;/h3-9H,10H2,1-2H3,(H,15,16);1H/q+1;/p-1