dimethyl 2-(4-bromanyl-6-pyridin-2-yl-pyridin-2-yl)pyridine-3,4-dicarboxylate

Systemtic Name: dimethyl 2-(4-bromanyl-6-pyridin-2-yl-pyridin-2-yl)pyridine-3,4-dicarboxylate Openeye Name: dimethyl 2-[4-bromo-6-(2-pyridyl)-2-pyridyl]pyridine-3,4-dicarboxylate CAS Name: 2-[4-bromo-6-(2-pyridinyl)-2-pyridinyl]pyridine-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(4-bromo-6-pyridin-2-ylpyridin-2-yl)pyridine-3,4-dicarboxylate Traditional Name: 2-[4-bromo-6-(2-pyridyl)-2-pyridyl]pyridine-3,4-dicarboxylic acid dimethyl ester Formula: C19H14BrN3O4 MolecularWeight: 428.23616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NC=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C(=NC=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)Br)C(=O)OC

InChI

InChI=1S/C19H14BrN3O4/c1-26-18(24)12-6-8-22-17(16(12)19(25)27-2)15-10-11(20)9-14(23-15)13-5-3-4-7-21-13/h3-10H,1-2H3