3-ethanoyl-3-ethyl-1,3-benzothiazol-3-ium-2-one

Systemtic Name: 3-ethanoyl-3-ethyl-1,3-benzothiazol-3-ium-2-one Openeye Name: 3-acetyl-3-ethyl-1,3-benzothiazol-3-ium-2-one CAS Name: 3-acetyl-3-ethyl-1,3-benzothiazol-3-ium-2-one IUPAC Name: 3-acetyl-3-ethyl-1,3-benzothiazol-3-ium-2-one Traditional Name: 3-acetyl-3-ethyl-1,3-benzothiazol-3-ium-2-one Formula: C11H12NO2S+ MolecularWeight: 222.28348

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C2=CC=CC=C2SC1=O)C(=O)C

Isomeric SMILES

CC[N+]1(C2=CC=CC=C2SC1=O)C(=O)C

InChI

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