4-[(5-aminocarbonyl-1H-imidazol-4-yl)oxycarbonyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-[(5-aminocarbonyl-1H-imidazol-4-yl)oxycarbonyl]benzene-1,3-dicarboxylic acid Openeye Name: 4-[(5-carbamoyl-1H-imidazol-4-yl)oxycarbonyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[(5-carbamoyl-1H-imidazol-4-yl)oxy-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[(5-carbamoyl-1H-imidazol-4-yl)oxycarbonyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[(5-carbamoyl-1H-imidazol-4-yl)oxycarbonyl]isophthalic acid Formula: C13H9N3O7 MolecularWeight: 319.22646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OC2=C(NC=N2)C(=O)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OC2=C(NC=N2)C(=O)N

InChI

InChI=1S/C13H9N3O7/c14-9(17)8-10(16-4-15-8)23-13(22)6-2-1-5(11(18)19)3-7(6)12(20)21/h1-4H,(H2,14,17)(H,15,16)(H,18,19)(H,20,21)