2-[[3-[(2-carboxyphenyl)amino]quinoxalin-2-yl]amino]benzoic acid

Systemtic Name: 2-[[3-[(2-carboxyphenyl)amino]quinoxalin-2-yl]amino]benzoic acid Openeye Name: 2-[[3-(2-carboxyanilino)quinoxalin-2-yl]amino]benzoic acid CAS Name: 2-[[3-(2-carboxyanilino)-2-quinoxalinyl]amino]benzoic acid IUPAC Name: 2-[[3-(2-carboxyanilino)quinoxalin-2-yl]amino]benzoic acid Traditional Name: 2-[[3-(2-carboxyanilino)quinoxalin-2-yl]amino]benzoic acid Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=NC3=CC=CC=C3N=C2NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=NC3=CC=CC=C3N=C2NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H16N4O4/c27-21(28)13-7-1-3-9-15(13)23-19-20(26-18-12-6-5-11-17(18)25-19)24-16-10-4-2-8-14(16)22(29)30/h1-12H,(H,23,25)(H,24,26)(H,27,28)(H,29,30)