4-(2,6-dipyridin-2-ylpyridin-4-yl)benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(2,6-dipyridin-2-ylpyridin-4-yl)benzene-1,3-dicarboxylic acid Openeye Name: 4-[2,6-bis(2-pyridyl)-4-pyridyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[2,6-bis(2-pyridinyl)-4-pyridinyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(2,6-dipyridin-2-ylpyridin-4-yl)benzene-1,3-dicarboxylic acid Traditional Name: 4-[2,6-bis(2-pyridyl)-4-pyridyl]isophthalic acid Formula: C23H15N3O4 MolecularWeight: 397.3829

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=C(C=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=C(C=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C23H15N3O4/c27-22(28)14-7-8-16(17(11-14)23(29)30)15-12-20(18-5-1-3-9-24-18)26-21(13-15)19-6-2-4-10-25-19/h1-13H,(H,27,28)(H,29,30)