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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NC3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C15H11NO2S/c17-15(18)11-6-2-1-5-10(11)9-14-16-12-7-3-4-8-13(12)19-14/h1-8H,9H2,(H,17,18)