2-(4-chloranyl-2H-1,3-benzothiazol-3-yl)-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-(4-chloranyl-2H-1,3-benzothiazol-3-yl)-2-oxidanylidene-ethanoic acid Openeye Name: 2-(4-chloro-2H-1,3-benzothiazol-3-yl)-2-oxo-acetic acid CAS Name: 2-(4-chloro-2H-1,3-benzothiazol-3-yl)-2-oxoacetic acid IUPAC Name: 2-(4-chloro-2H-1,3-benzothiazol-3-yl)-2-oxoacetic acid Traditional Name: 2-(4-chloro-2H-1,3-benzothiazol-3-yl)-2-keto-acetic acid Formula: C9H6ClNO3S MolecularWeight: 243.66684

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=C(S1)C=CC=C2Cl)C(=O)C(=O)O

Isomeric SMILES

C1N(C2=C(S1)C=CC=C2Cl)C(=O)C(=O)O

InChI

InChI=1S/C9H6ClNO3S/c10-5-2-1-3-6-7(5)11(4-15-6)8(12)9(13)14/h1-3H,4H2,(H,13,14)