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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)O

InChI

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