(1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol

Systemtic Name: (1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol Openeye Name: (1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol CAS Name: (1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol IUPAC Name: (1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol Traditional Name: (1S)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)ethanol Formula: C10H12NOS+ MolecularWeight: 194.27338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[N+](C2=CC=CC=C2S1)C)O

Isomeric SMILES

C[C@@H](C1=[N+](C2=CC=CC=C2S1)C)O

InChI

InChI=1S/C10H12NOS/c1-7(12)10-11(2)8-5-3-4-6-9(8)13-10/h3-7,12H,1-2H3/q+1/t7-/m0/s1