2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid

Systemtic Name: 2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid Openeye Name: 2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid CAS Name: 2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid IUPAC Name: 2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid Traditional Name: 2-(5-methyl-1,3-benzothiazol-2-yl)benzoic acid Formula: C15H11NO2S MolecularWeight: 269.31834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C15H11NO2S/c1-9-6-7-13-12(8-9)16-14(19-13)10-4-2-3-5-11(10)15(17)18/h2-8H,1H3,(H,17,18)