2-phenyl-4H-1,3-oxazol-3-ium-5-one iodide

Systemtic Name: 2-phenyl-4H-1,3-oxazol-3-ium-5-one iodide Openeye Name: 2-phenyl-4H-oxazol-3-ium-5-one iodide CAS Name: 2-phenyl-4H-oxazol-3-ium-5-one iodide IUPAC Name: 2-phenyl-4H-1,3-oxazol-3-ium-5-one iodide Traditional Name: 2-phenyl-2-oxazolin-3-ium-5-one iodide Formula: C9H8INO2 MolecularWeight: 289.06979

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)OC(=[NH+]1)C2=CC=CC=C2.[I-]

Isomeric SMILES

C1C(=O)OC(=[NH+]1)C2=CC=CC=C2.[I-]

InChI

InChI=1S/C9H7NO2.HI/c11-8-6-10-9(12-8)7-4-2-1-3-5-7;/h1-5H,6H2;1H