5-[[3-(4-aminophenyl)-3-oxidanylidene-propanoyl]amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[3-(4-aminophenyl)-3-oxidanylidene-propanoyl]amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[3-(4-aminophenyl)-3-oxo-propanoyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[3-(4-aminophenyl)-1,3-dioxopropyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[3-(4-aminophenyl)-3-oxopropanoyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[3-(4-aminophenyl)-3-keto-propanoyl]amino]isophthalic acid Formula: C17H14N2O6 MolecularWeight: 342.30286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)N

InChI

InChI=1S/C17H14N2O6/c18-12-3-1-9(2-4-12)14(20)8-15(21)19-13-6-10(16(22)23)5-11(7-13)17(24)25/h1-7H,8,18H2,(H,19,21)(H,22,23)(H,24,25)