4-(4-oxidanyl-1,3-benzothiazol-2-yl)benzoic acid

Systemtic Name: 4-(4-oxidanyl-1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 4-(4-hydroxy-1,3-benzothiazol-2-yl)benzoic acid CAS Name: 4-(4-hydroxy-1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 4-(4-hydroxy-1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 4-(4-hydroxy-1,3-benzothiazol-2-yl)benzoic acid Formula: C14H9NO3S MolecularWeight: 271.29116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=N2)C3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC(=C2C(=C1)SC(=N2)C3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C14H9NO3S/c16-10-2-1-3-11-12(10)15-13(19-11)8-4-6-9(7-5-8)14(17)18/h1-7,16H,(H,17,18)