1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide

Systemtic Name: 1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide Openeye Name: 1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide CAS Name: 1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide IUPAC Name: 1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide Traditional Name: 1-[5-(phenoxymethyl)-1H-pyrazol-3-yl]pyridin-1-ium bromide Formula: C15H14BrN3O MolecularWeight: 332.19516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC(=NN2)[N+]3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC(=NN2)[N+]3=CC=CC=C3.[Br-]

InChI

InChI=1S/C15H14N3O.BrH/c1-3-7-14(8-4-1)19-12-13-11-15(17-16-13)18-9-5-2-6-10-18;/h1-11H,12H2,(H,16,17);1H/q+1;/p-1