disodium 4-[1-(4-oxidanidylphenyl)-3-oxidanylidene-2-benzofuran-1-yl]phenolate

Systemtic Name: disodium 4-[1-(4-oxidanidylphenyl)-3-oxidanylidene-2-benzofuran-1-yl]phenolate Openeye Name: disodium 4-[1-(4-oxidophenyl)-3-oxo-isobenzofuran-1-yl]phenolate CAS Name: disodium 4-[1-(4-oxidophenyl)-3-oxo-1-isobenzofuranyl]phenolate IUPAC Name: disodium 4-[1-(4-oxidophenyl)-3-oxo-2-benzofuran-1-yl]phenolate Traditional Name: disodium 4-[3-keto-1-(4-oxidophenyl)phthalan-1-yl]phenolate Formula: C20H12Na2O4 MolecularWeight: 362.28642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)[O-])C4=CC=C(C=C4)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)[O-])C4=CC=C(C=C4)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H14O4.2Na/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20;;/h1-12,21-22H;;/q;2*+1/p-2