4-methyl-2-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)phenol bromide

Systemtic Name: 4-methyl-2-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)phenol bromide Openeye Name: 2-isoxazolo[2,3-a]pyridin-8-ium-2-yl-4-methyl-phenol bromide CAS Name: 2-(2-isoxazolo[2,3-a]pyridin-8-iumyl)-4-methylphenol bromide IUPAC Name: 4-methyl-2-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)phenol bromide Traditional Name: 2-isoxazolo[2,3-a]pyridin-8-ium-2-yl-4-methyl-phenol bromide Formula: C14H12BrNO2 MolecularWeight: 306.15458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C2=CC3=CC=CC=[N+]3O2.[Br-]

Isomeric SMILES

CC1=CC(=C(C=C1)O)C2=CC3=CC=CC=[N+]3O2.[Br-]

InChI

InChI=1S/C14H11NO2.BrH/c1-10-5-6-13(16)12(8-10)14-9-11-4-2-3-7-15(11)17-14;/h2-9H,1H3;1H