2-(6-chloranyl-1,3-benzothiazol-2-yl)benzoic acid

Systemtic Name: 2-(6-chloranyl-1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 2-(6-chloro-1,3-benzothiazol-2-yl)benzoic acid CAS Name: 2-(6-chloro-1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 2-(6-chloro-1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 2-(6-chloro-1,3-benzothiazol-2-yl)benzoic acid Formula: C14H8ClNO2S MolecularWeight: 289.73682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C14H8ClNO2S/c15-8-5-6-11-12(7-8)19-13(16-11)9-3-1-2-4-10(9)14(17)18/h1-7H,(H,17,18)