4-[[1,3-bis(oxidanylidene)-2-benzofuran-5-yl]carbonyl]benzoic acid

Systemtic Name: 4-[[1,3-bis(oxidanylidene)-2-benzofuran-5-yl]carbonyl]benzoic acid Openeye Name: 4-(1,3-dioxoisobenzofuran-5-carbonyl)benzoic acid CAS Name: 4-[(1,3-dioxo-5-isobenzofuranyl)-oxomethyl]benzoic acid IUPAC Name: 4-(1,3-dioxo-2-benzofuran-5-carbonyl)benzoic acid Traditional Name: 4-(1,3-diketophthalan-5-carbonyl)benzoic acid Formula: C16H8O6 MolecularWeight: 296.23112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)OC3=O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)OC3=O)C(=O)O

InChI

InChI=1S/C16H8O6/c17-13(8-1-3-9(4-2-8)14(18)19)10-5-6-11-12(7-10)16(21)22-15(11)20/h1-7H,(H,18,19)