dimethyl 5-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-(3-phthalimidopropanoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C21H18N2O7/c1-29-20(27)12-9-13(21(28)30-2)11-14(10-12)22-17(24)7-8-23-18(25)15-5-3-4-6-16(15)19(23)26/h3-6,9-11H,7-8H2,1-2H3,(H,22,24)