2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(4-methylphenyl)ethanone bromide

Systemtic Name: 2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(4-methylphenyl)ethanone bromide Openeye Name: 2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(p-tolyl)ethanone bromide CAS Name: 2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(4-methylphenyl)ethanone bromide IUPAC Name: 2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(4-methylphenyl)ethanone bromide Traditional Name: 2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)-1-(p-tolyl)ethanone bromide Formula: C17H16BrNO2 MolecularWeight: 346.21844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=C(OC3=CC=CC=C32)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=C(OC3=CC=CC=C32)C.[Br-]

InChI

InChI=1S/C17H16NO2.BrH/c1-12-7-9-14(10-8-12)16(19)11-18-13(2)20-17-6-4-3-5-15(17)18;/h3-10H,11H2,1-2H3;1H/q+1;/p-1