5-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-5-(1,3-dioxoisoindolin-2-yl)oxy-4-oxo-pentanoic acid CAS Name: 5-[(1,3-dioxo-2-isoindolyl)oxy]-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-(1,3-dioxoisoindol-2-yl)oxy-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-keto-5-phthalimidooxy-valeric acid Formula: C21H18N2O8 MolecularWeight: 426.37622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CON2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CON2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H18N2O8/c24-17(12-31-23-19(27)14-8-4-5-9-15(14)20(23)28)16(10-18(25)26)22-21(29)30-11-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,22,29)(H,25,26)