3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide

Systemtic Name: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide Openeye Name: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide CAS Name: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide IUPAC Name: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide Traditional Name: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium hydroiodide Formula: C10H13INS+ MolecularWeight: 306.18639

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC=CC=C21)C.I

Isomeric SMILES

CC[N+]1=C(SC2=CC=CC=C21)C.I

InChI

InChI=1S/C10H12NS.HI/c1-3-11-8(2)12-10-7-5-4-6-9(10)11;/h4-7H,3H2,1-2H3;1H/q+1;