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

Systemtic Name: 4-bromanyl-3-(3,5-dimethylphenyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-bromo-3-(3,5-dimethylphenyl)oxadiazol-3-ium-5-olate CAS Name: 4-bromo-3-(3,5-dimethylphenyl)-5-oxadiazol-3-iumolate IUPAC Name: 4-bromo-3-(3,5-dimethylphenyl)oxadiazol-3-ium-5-olate Traditional Name: 4-bromo-3-(3,5-dimethylphenyl)oxadiazol-3-ium-5-olate Formula: C10H9BrN2O2 MolecularWeight: 269.09466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)[N+]2=NOC(=C2Br)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)[N+]2=NOC(=C2Br)[O-])C

InChI

InChI=1S/C10H9BrN2O2/c1-6-3-7(2)5-8(4-6)13-9(11)10(14)15-12-13/h3-5H,1-2H3