4-[(5-acetamidopyridin-2-yl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-[(5-acetamidopyridin-2-yl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 4-[(5-acetamido-2-pyridyl)amino]benzene-1,3-dicarboxylic acid CAS Name: 4-[(5-acetamido-2-pyridinyl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[(5-acetamidopyridin-2-yl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 4-[(5-acetamido-2-pyridyl)amino]isophthalic acid Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN=C(C=C1)NC2=C(C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC1=CN=C(C=C1)NC2=C(C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C15H13N3O5/c1-8(19)17-10-3-5-13(16-7-10)18-12-4-2-9(14(20)21)6-11(12)15(22)23/h2-7H,1H3,(H,16,18)(H,17,19)(H,20,21)(H,22,23)