3-[4-methoxy-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid

Systemtic Name: 3-[4-methoxy-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid Openeye Name: 3-(4-methoxy-1,3-dioxo-isoindolin-2-yl)propanoic acid CAS Name: 3-(4-methoxy-1,3-dioxo-2-isoindolyl)propanoic acid IUPAC Name: 3-(4-methoxy-1,3-dioxoisoindol-2-yl)propanoic acid Traditional Name: 3-(1,3-diketo-4-methoxy-isoindolin-2-yl)propionic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)N(C2=O)CCC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C(=O)N(C2=O)CCC(=O)O

InChI

InChI=1S/C12H11NO5/c1-18-8-4-2-3-7-10(8)12(17)13(11(7)16)6-5-9(14)15/h2-4H,5-6H2,1H3,(H,14,15)