N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]ethanamide iodide

Systemtic Name: N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]ethanamide iodide Openeye Name: N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]acetamide iodide CAS Name: N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]acetamide iodide IUPAC Name: N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]acetamide iodide Traditional Name: N-[3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium-5-yl]acetamide iodide Formula: C12H15IN2O2S MolecularWeight: 378.22917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=CC(=C2)NC(=O)C)CCO.[I-]

Isomeric SMILES

CC1=[N+](C2=C(S1)C=CC(=C2)NC(=O)C)CCO.[I-]

InChI

InChI=1S/C12H14N2O2S.HI/c1-8(16)13-10-3-4-12-11(7-10)14(5-6-15)9(2)17-12;/h3-4,7,15H,5-6H2,1-2H3;1H