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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)[N+]2=NOC(=C2)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)[N+]2=NOC(=C2)[O-]

InChI

InChI=1S/C10H9BrN2O2/c1-2-7-5-8(11)3-4-9(7)13-6-10(14)15-12-13/h3-6H,2H2,1H3