4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-oxidanylidene-butanoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-oxidanylidene-butanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-3-oxo-butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)-3-oxobutanoate IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-3-oxobutanoate Traditional Name: 3-keto-4-phthalimido-butyrate Formula: C12H8NO5- MolecularWeight: 246.19562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)CC(=O)[O-]

InChI

InChI=1S/C12H9NO5/c14-7(5-10(15)16)6-13-11(17)8-3-1-2-4-9(8)12(13)18/h1-4H,5-6H2,(H,15,16)/p-1