[6-chloranyl-2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [6-chloranyl-2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [6-chloro-2-(3,4-dimethoxyphenyl)-4-oxo-chromen-3-yl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [6-chloro-2-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(3,4-dimethoxyphenyl)-4-oxochromen-3-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [6-chloro-2-(3,4-dimethoxyphenyl)-4-keto-chromen-3-yl] ester Formula: C23H15BrClNO6 MolecularWeight: 516.7253

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4=CC(=CN=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4=CC(=CN=C4)Br)OC

InChI

InChI=1S/C23H15BrClNO6/c1-29-18-5-3-12(8-19(18)30-2)21-22(32-23(28)13-7-14(24)11-26-10-13)20(27)16-9-15(25)4-6-17(16)31-21/h3-11H,1-2H3