2-(3-methylbenzotriazol-3-ium-1-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(3-methylbenzotriazol-3-ium-1-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(3-methylbenzotriazol-3-ium-1-yl)-1-phenyl-ethanone bromide CAS Name: 2-(3-methyl-1-benzotriazol-3-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(3-methylbenzotriazol-3-ium-1-yl)-1-phenylethanone bromide Traditional Name: 2-(3-methylbenzotriazol-3-ium-1-yl)-1-phenyl-ethanone bromide Formula: C15H14BrN3O MolecularWeight: 332.19516

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NN(C2=CC=CC=C21)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C[N+]1=NN(C2=CC=CC=C21)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C15H14N3O.BrH/c1-17-13-9-5-6-10-14(13)18(16-17)11-15(19)12-7-3-2-4-8-12;/h2-10H,11H2,1H3;1H/q+1;/p-1