4,5-dimethoxy-2-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid CAS Name: 4,5-dimethoxy-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid Traditional Name: 2-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonylamino]-4,5-dimethoxy-benzoic acid Formula: C16H14N2O8S MolecularWeight: 394.35596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)OC

InChI

InChI=1S/C16H14N2O8S/c1-24-13-6-9(15(19)20)11(7-14(13)25-2)18-27(22,23)8-3-4-10-12(5-8)26-16(21)17-10/h3-7,18H,1-2H3,(H,17,21)(H,19,20)