1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide

Systemtic Name: 1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide Openeye Name: 1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide CAS Name: 1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide IUPAC Name: 1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide Traditional Name: 1,2,3,5-tetrahydropyrrolo[1,2-a][3,1]benzoxazin-10-ium iodide Formula: C11H12INO MolecularWeight: 301.12355

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=[N+](C1)C3=CC=CC=C3CO2.[I-]

Isomeric SMILES

C1CC2=[N+](C1)C3=CC=CC=C3CO2.[I-]

InChI

InChI=1S/C11H12NO.HI/c1-2-5-10-9(4-1)8-13-11-6-3-7-12(10)11;/h1-2,4-5H,3,6-8H2;1H/q+1;/p-1