7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide

Systemtic Name: 7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide Openeye Name: 7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide CAS Name: 7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide IUPAC Name: 7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide Traditional Name: 7-ethyl-6-methyl-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-ium iodide Formula: C11H12INO2S MolecularWeight: 349.18795

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC3=C(C=C21)OCO3)C.[I-]

Isomeric SMILES

CC[N+]1=C(SC2=CC3=C(C=C21)OCO3)C.[I-]

InChI

InChI=1S/C11H12NO2S.HI/c1-3-12-7(2)15-11-5-10-9(4-8(11)12)13-6-14-10;/h4-5H,3,6H2,1-2H3;1H/q+1;/p-1