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

Systemtic Name: [2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(4-methoxyphenyl)-7-methyl-4-oxo-chromen-3-yl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-(4-methoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [4-keto-2-(4-methoxyphenyl)-7-methyl-chromen-3-yl] ester Formula: C23H16BrNO5 MolecularWeight: 466.28084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C23H16BrNO5/c1-13-3-8-18-19(9-13)29-21(14-4-6-17(28-2)7-5-14)22(20(18)26)30-23(27)15-10-16(24)12-25-11-15/h3-12H,1-2H3