5-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]benzene-1,3-dicarboxylate Openeye Name: 5-[(4-oxido-4-oxo-butanoyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[(4-oxido-1,4-dioxobutyl)amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[(4-oxido-4-oxobutanoyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-keto-4-oxido-butanoyl)amino]isophthalate Formula: C12H8NO7-3 MolecularWeight: 278.19442

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)[O-])NC(=O)CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C=C1C(=O)[O-])NC(=O)CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H11NO7/c14-9(1-2-10(15)16)13-8-4-6(11(17)18)3-7(5-8)12(19)20/h3-5H,1-2H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)/p-3