2-[4-(4-bromophenyl)-6-(4-carboxypyridin-2-yl)pyridin-2-yl]pyridine-4-carboxylic acid

Systemtic Name: 2-[4-(4-bromophenyl)-6-(4-carboxypyridin-2-yl)pyridin-2-yl]pyridine-4-carboxylic acid Openeye Name: 2-[4-(4-bromophenyl)-6-(4-carboxy-2-pyridyl)-2-pyridyl]pyridine-4-carboxylic acid CAS Name: 2-[4-(4-bromophenyl)-6-(4-carboxy-2-pyridinyl)-2-pyridinyl]-4-pyridinecarboxylic acid IUPAC Name: 2-[4-(4-bromophenyl)-6-(4-carboxypyridin-2-yl)pyridin-2-yl]pyridine-4-carboxylic acid Traditional Name: 2-[4-(4-bromophenyl)-6-(4-carboxy-2-pyridyl)-2-pyridyl]isonicotinic acid Formula: C23H14BrN3O4 MolecularWeight: 476.27896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NC(=C2)C3=NC=CC(=C3)C(=O)O)C4=NC=CC(=C4)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NC(=C2)C3=NC=CC(=C3)C(=O)O)C4=NC=CC(=C4)C(=O)O)Br

InChI

InChI=1S/C23H14BrN3O4/c24-17-3-1-13(2-4-17)16-11-20(18-9-14(22(28)29)5-7-25-18)27-21(12-16)19-10-15(23(30)31)6-8-26-19/h1-12H,(H,28,29)(H,30,31)