4-bromanyl-3-[4-(4-nitrophenyl)sulfonylphenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-bromanyl-3-[4-(4-nitrophenyl)sulfonylphenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-bromo-3-[4-(4-nitrophenyl)sulfonylphenyl]oxadiazol-3-ium-5-olate CAS Name: 4-bromo-3-[4-(4-nitrophenyl)sulfonylphenyl]-5-oxadiazol-3-iumolate IUPAC Name: 4-bromo-3-[4-(4-nitrophenyl)sulfonylphenyl]oxadiazol-3-ium-5-olate Traditional Name: 4-bromo-3-(4-nosylphenyl)oxadiazol-3-ium-5-olate Formula: C14H8BrN3O6S MolecularWeight: 426.19882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+]2=NOC(=C2Br)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+]2=NOC(=C2Br)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H8BrN3O6S/c15-13-14(19)24-16-17(13)9-1-5-11(6-2-9)25(22,23)12-7-3-10(4-8-12)18(20)21/h1-8H