5-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(3-keto-4,5-dimethoxy-phthalan-1-yl)amino]isophthalic acid Formula: C18H15NO8 MolecularWeight: 373.3136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C18H15NO8/c1-25-12-4-3-11-13(14(12)26-2)18(24)27-15(11)19-10-6-8(16(20)21)5-9(7-10)17(22)23/h3-7,15,19H,1-2H3,(H,20,21)(H,22,23)