4-[4,5-dimethoxy-1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanyl-benzoate

Systemtic Name: 4-[4,5-dimethoxy-1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanyl-benzoate Openeye Name: 4-(4,5-dimethoxy-1,3-dioxo-isoindolin-2-yl)-2-hydroxy-benzoate CAS Name: 4-(4,5-dimethoxy-1,3-dioxo-2-isoindolyl)-2-hydroxybenzoate IUPAC Name: 4-(4,5-dimethoxy-1,3-dioxoisoindol-2-yl)-2-hydroxybenzoate Traditional Name: 4-(1,3-diketo-4,5-dimethoxy-isoindolin-2-yl)-2-hydroxy-benzoate Formula: C17H12NO7- MolecularWeight: 342.27968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)N(C2=O)C3=CC(=C(C=C3)C(=O)[O-])O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)N(C2=O)C3=CC(=C(C=C3)C(=O)[O-])O)OC

InChI

InChI=1S/C17H13NO7/c1-24-12-6-5-10-13(14(12)25-2)16(21)18(15(10)20)8-3-4-9(17(22)23)11(19)7-8/h3-7,19H,1-2H3,(H,22,23)/p-1