2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol

Systemtic Name: 2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol Openeye Name: 2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol CAS Name: 2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol IUPAC Name: 2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol Traditional Name: 2-(2,5-dimethyl-1,3-benzothiazol-3-ium-3-yl)ethanol Formula: C11H14NOS+ MolecularWeight: 208.29996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=[N+]2CCO)C

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=[N+]2CCO)C

InChI

InChI=1S/C11H14NOS/c1-8-3-4-11-10(7-8)12(5-6-13)9(2)14-11/h3-4,7,13H,5-6H2,1-2H3/q+1