5-chloranyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-benzoxazole iodide

Systemtic Name: 5-chloranyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-benzoxazole iodide Openeye Name: 5-chloro-2-(1-methylpyridin-1-ium-3-yl)-1,3-benzoxazole iodide CAS Name: 5-chloro-2-(1-methyl-3-pyridin-1-iumyl)-1,3-benzoxazole iodide IUPAC Name: 5-chloro-2-(1-methylpyridin-1-ium-3-yl)-1,3-benzoxazole iodide Traditional Name: 5-chloro-2-(1-methylpyridin-1-ium-3-yl)-1,3-benzoxazole iodide Formula: C13H10ClIN2O MolecularWeight: 372.58877

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)Cl.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)Cl.[I-]

InChI

InChI=1S/C13H10ClN2O.HI/c1-16-6-2-3-9(8-16)13-15-11-7-10(14)4-5-12(11)17-13;/h2-8H,1H3;1H/q+1;/p-1