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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 3-(1,3-benzothiazol-2-yl)benzoic acid CAS Name: 3-(1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 3-(1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 3-(1,3-benzothiazol-2-yl)benzoic acid Formula: C14H9NO2S MolecularWeight: 255.29176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C14H9NO2S/c16-14(17)10-5-3-4-9(8-10)13-15-11-6-1-2-7-12(11)18-13/h1-8H,(H,16,17)