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

Systemtic Name: 4-[4-[[1,3-bis(oxidanylidene)-2-benzofuran-5-yl]carbonyl]phenoxy]benzoic acid Openeye Name: 4-[4-(1,3-dioxoisobenzofuran-5-carbonyl)phenoxy]benzoic acid CAS Name: 4-[4-[(1,3-dioxo-5-isobenzofuranyl)-oxomethyl]phenoxy]benzoic acid IUPAC Name: 4-[4-(1,3-dioxo-2-benzofuran-5-carbonyl)phenoxy]benzoic acid Traditional Name: 4-[4-(1,3-diketophthalan-5-carbonyl)phenoxy]benzoic acid Formula: C22H12O7 MolecularWeight: 388.32648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)OC3=O)OC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)OC3=O)OC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H12O7/c23-19(14-5-10-17-18(11-14)22(27)29-21(17)26)12-1-6-15(7-2-12)28-16-8-3-13(4-9-16)20(24)25/h1-11H,(H,24,25)