6-(1,3-benzothiazol-2-yl)-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-(1,3-benzothiazol-2-yl)-2,3-dimethoxy-benzoic acid Openeye Name: 6-(1,3-benzothiazol-2-yl)-2,3-dimethoxy-benzoic acid CAS Name: 6-(1,3-benzothiazol-2-yl)-2,3-dimethoxybenzoic acid IUPAC Name: 6-(1,3-benzothiazol-2-yl)-2,3-dimethoxybenzoic acid Traditional Name: 6-(1,3-benzothiazol-2-yl)-2,3-dimethoxy-benzoic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NC3=CC=CC=C3S2)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NC3=CC=CC=C3S2)C(=O)O)OC

InChI

InChI=1S/C16H13NO4S/c1-20-11-8-7-9(13(16(18)19)14(11)21-2)15-17-10-5-3-4-6-12(10)22-15/h3-8H,1-2H3,(H,18,19)