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

Systemtic Name: 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-butanoate Openeye Name: 2-[(1,3-dioxoisoindolin-2-yl)methyl]-3-oxo-butanoate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methyl]-3-oxobutanoate IUPAC Name: 2-[(1,3-dioxoisoindol-2-yl)methyl]-3-oxobutanoate Traditional Name: 3-keto-2-(phthalimidomethyl)butyrate Formula: C13H10NO5- MolecularWeight: 260.2222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)[O-]

Isomeric SMILES

CC(=O)C(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)[O-]

InChI

InChI=1S/C13H11NO5/c1-7(15)10(13(18)19)6-14-11(16)8-4-2-3-5-9(8)12(14)17/h2-5,10H,6H2,1H3,(H,18,19)/p-1