4-[(3,4-dicarboxyphenyl)amino]phthalic acid

Systemtic Name: 4-[(3,4-dicarboxyphenyl)amino]phthalic acid Openeye Name: 4-(3,4-dicarboxyanilino)phthalic acid CAS Name: 4-(3,4-dicarboxyanilino)phthalic acid IUPAC Name: 4-(3,4-dicarboxyanilino)phthalic acid Traditional Name: 4-(3,4-dicarboxyanilino)phthalic acid Formula: C16H11NO8 MolecularWeight: 345.26044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NC2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H11NO8/c18-13(19)9-3-1-7(5-11(9)15(22)23)17-8-2-4-10(14(20)21)12(6-8)16(24)25/h1-6,17H,(H,18,19)(H,20,21)(H,22,23)(H,24,25)