[6-chloranyl-2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [6-chloranyl-2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxo-chromen-3-yl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [6-chloro-4-keto-2-(4-methoxyphenyl)-7-methyl-chromen-3-yl] ester Formula: C23H15BrClNO5 MolecularWeight: 500.7259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CN=C3)Br)C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CN=C3)Br)C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C23H15BrClNO5/c1-12-7-19-17(9-18(12)25)20(27)22(31-23(28)14-8-15(24)11-26-10-14)21(30-19)13-3-5-16(29-2)6-4-13/h3-11H,1-2H3