2-(6-chloranyl-2-methyl-1,3-benzothiazol-3-ium-3-yl)ethanoic acid

Systemtic Name: 2-(6-chloranyl-2-methyl-1,3-benzothiazol-3-ium-3-yl)ethanoic acid Openeye Name: 2-(6-chloro-2-methyl-1,3-benzothiazol-3-ium-3-yl)acetic acid CAS Name: 2-(6-chloro-2-methyl-1,3-benzothiazol-3-ium-3-yl)acetic acid IUPAC Name: 2-(6-chloro-2-methyl-1,3-benzothiazol-3-ium-3-yl)acetic acid Traditional Name: 2-(6-chloro-2-methyl-1,3-benzothiazol-3-ium-3-yl)acetic acid Formula: C10H9ClNO2S+ MolecularWeight: 242.70196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=C(C=C2)Cl)CC(=O)O

Isomeric SMILES

CC1=[N+](C2=C(S1)C=C(C=C2)Cl)CC(=O)O

InChI

InChI=1S/C10H8ClNO2S/c1-6-12(5-10(13)14)8-3-2-7(11)4-9(8)15-6/h2-4H,5H2,1H3/p+1