5-[[4-(4-nitrophenoxy)phenyl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[4-(4-nitrophenoxy)phenyl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[4-(4-nitrophenoxy)benzoyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[4-(4-nitrophenoxy)phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[4-(4-nitrophenoxy)benzoyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[4-(4-nitrophenoxy)benzoyl]amino]isophthalic acid Formula: C21H14N2O8 MolecularWeight: 422.34446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O8/c24-19(22-15-10-13(20(25)26)9-14(11-15)21(27)28)12-1-5-17(6-2-12)31-18-7-3-16(4-8-18)23(29)30/h1-11H,(H,22,24)(H,25,26)(H,27,28)