2-(3-carboxylato-4-morpholin-4-yl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-(3-carboxylato-4-morpholin-4-yl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(3-carboxylato-4-morpholino-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[3-carboxylato-4-(4-morpholinyl)phenyl]-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(3-carboxylato-4-morpholin-4-ylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(3-carboxylato-4-morpholino-phenyl)-1,3-diketo-isoindoline-5-carboxylate Formula: C20H14N2O7-2 MolecularWeight: 394.33436

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H16N2O7/c23-17-13-3-1-11(19(25)26)9-14(13)18(24)22(17)12-2-4-16(15(10-12)20(27)28)21-5-7-29-8-6-21/h1-4,9-10H,5-8H2,(H,25,26)(H,27,28)/p-2