2,2-dimethyl-3H-1,2-benzoxazol-2-ium iodide

Systemtic Name: 2,2-dimethyl-3H-1,2-benzoxazol-2-ium iodide Openeye Name: 2,2-dimethyl-3H-1,2-benzoxazol-2-ium iodide CAS Name: 2,2-dimethyl-3H-1,2-benzoxazol-2-ium iodide IUPAC Name: 2,2-dimethyl-3H-1,2-benzoxazol-2-ium iodide Traditional Name: 2,2-dimethyl-3H-indoxazen-2-ium iodide Formula: C9H12INO MolecularWeight: 277.10215

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2=CC=CC=C2O1)C.[I-]

Isomeric SMILES

C[N+]1(CC2=CC=CC=C2O1)C.[I-]

InChI

InChI=1S/C9H12NO.HI/c1-10(2)7-8-5-3-4-6-9(8)11-10;/h3-6H,7H2,1-2H3;1H/q+1;/p-1