2-(2-methylbenzo[e][1,3]benzothiazol-1-ium-1-yl)ethanol iodide

Systemtic Name: 2-(2-methylbenzo[e][1,3]benzothiazol-1-ium-1-yl)ethanol iodide Openeye Name: 2-(2-methylbenzo[e][1,3]benzothiazol-1-ium-1-yl)ethanol iodide CAS Name: 2-(2-methyl-1-benzo[e][1,3]benzothiazol-1-iumyl)ethanol iodide IUPAC Name: 2-(2-methylbenzo[e][1,3]benzothiazol-1-ium-1-yl)ethanol iodide Traditional Name: 2-(2-methylbenzo[e][1,3]benzothiazol-1-ium-1-yl)ethanol iodide Formula: C14H14INOS MolecularWeight: 371.23653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCO.[I-]

Isomeric SMILES

CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCO.[I-]

InChI

InChI=1S/C14H14NOS.HI/c1-10-15(8-9-16)14-12-5-3-2-4-11(12)6-7-13(14)17-10;/h2-7,16H,8-9H2,1H3;1H/q+1;/p-1