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

Systemtic Name: 5-[[1,3-bis(oxidanylidene)-2-propyl-isoindol-5-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: 5-[(1,3-dioxo-2-propyl-isoindoline-5-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(1,3-dioxo-2-propyl-5-isoindolyl)-oxomethyl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[(1,3-dioxo-2-propylisoindole-5-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1,3-diketo-2-propyl-isoindoline-5-carbonyl)amino]isophthalate Formula: C20H14N2O7-2 MolecularWeight: 394.33436

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H16N2O7/c1-2-5-22-17(24)14-4-3-10(9-15(14)18(22)25)16(23)21-13-7-11(19(26)27)6-12(8-13)20(28)29/h3-4,6-9H,2,5H2,1H3,(H,21,23)(H,26,27)(H,28,29)/p-2