2-[2-(2-methylphenyl)-1,3-benzothiazol-6-yl]ethanoic acid

Systemtic Name: 2-[2-(2-methylphenyl)-1,3-benzothiazol-6-yl]ethanoic acid Openeye Name: 2-[2-(o-tolyl)-1,3-benzothiazol-6-yl]acetic acid CAS Name: 2-[2-(2-methylphenyl)-1,3-benzothiazol-6-yl]acetic acid IUPAC Name: 2-[2-(2-methylphenyl)-1,3-benzothiazol-6-yl]acetic acid Traditional Name: 2-[2-(o-tolyl)-1,3-benzothiazol-6-yl]acetic acid Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(S2)C=C(C=C3)CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(S2)C=C(C=C3)CC(=O)O

InChI

InChI=1S/C16H13NO2S/c1-10-4-2-3-5-12(10)16-17-13-7-6-11(9-15(18)19)8-14(13)20-16/h2-8H,9H2,1H3,(H,18,19)