3-(4-bromanyl-2-methyl-phenyl)-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(4-bromanyl-2-methyl-phenyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(4-bromo-2-methyl-phenyl)oxadiazol-3-ium-5-olate CAS Name: 3-(4-bromo-2-methylphenyl)-5-oxadiazol-3-iumolate IUPAC Name: 3-(4-bromo-2-methylphenyl)oxadiazol-3-ium-5-olate Traditional Name: 3-(4-bromo-2-methyl-phenyl)oxadiazol-3-ium-5-olate Formula: C9H7BrN2O2 MolecularWeight: 255.06808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)[N+]2=NOC(=C2)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)[N+]2=NOC(=C2)[O-]

InChI

InChI=1S/C9H7BrN2O2/c1-6-4-7(10)2-3-8(6)12-5-9(13)14-11-12/h2-5H,1H3