3-(4-aminophenyl)-2H-1,2,3,4-oxatriazol-3-ium-5-one

Systemtic Name: 3-(4-aminophenyl)-2H-1,2,3,4-oxatriazol-3-ium-5-one Openeye Name: 3-(4-aminophenyl)-2H-oxatriazol-3-ium-5-one CAS Name: 3-(4-aminophenyl)-2H-oxatriazol-3-ium-5-one IUPAC Name: 3-(4-aminophenyl)-2H-oxatriazol-3-ium-5-one Traditional Name: 3-(4-aminophenyl)-2H-oxatriazol-3-ium-5-one Formula: C7H7N4O2+ MolecularWeight: 179.15608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)[N+]2=NC(=O)ON2

Isomeric SMILES

C1=CC(=CC=C1N)[N+]2=NC(=O)ON2

InChI

InChI=1S/C7H6N4O2/c8-5-1-3-6(4-2-5)11-9-7(12)13-10-11/h1-4H,(H2-,8,9,10,12)/p+1