1-(4-bromophenyl)-2-(3-methylbenzotriazol-3-ium-1-yl)ethanone

Systemtic Name: 1-(4-bromophenyl)-2-(3-methylbenzotriazol-3-ium-1-yl)ethanone Openeye Name: 1-(4-bromophenyl)-2-(3-methylbenzotriazol-3-ium-1-yl)ethanone CAS Name: 1-(4-bromophenyl)-2-(3-methyl-1-benzotriazol-3-iumyl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(3-methylbenzotriazol-3-ium-1-yl)ethanone Traditional Name: 1-(4-bromophenyl)-2-(3-methylbenzotriazol-3-ium-1-yl)ethanone Formula: C15H13BrN3O+ MolecularWeight: 331.18722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13BrN3O/c1-18-13-4-2-3-5-14(13)19(17-18)10-15(20)11-6-8-12(16)9-7-11/h2-9H,10H2,1H3/q+1