4-(4,5-dimethoxy-3-oxidanylidene-1H-isoindol-2-yl)benzoate

Systemtic Name: 4-(4,5-dimethoxy-3-oxidanylidene-1H-isoindol-2-yl)benzoate Openeye Name: 4-(6,7-dimethoxy-1-oxo-isoindolin-2-yl)benzoate CAS Name: 4-(4,5-dimethoxy-3-oxo-1H-isoindol-2-yl)benzoate IUPAC Name: 4-(4,5-dimethoxy-3-oxo-1H-isoindol-2-yl)benzoate Traditional Name: 4-(1-keto-6,7-dimethoxy-isoindolin-2-yl)benzoate Formula: C17H14NO5- MolecularWeight: 312.29676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO5/c1-22-13-8-5-11-9-18(16(19)14(11)15(13)23-2)12-6-3-10(4-7-12)17(20)21/h3-8H,9H2,1-2H3,(H,20,21)/p-1