(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 5-bromanylpyridine-3-carboxylate

Systemtic Name: (2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 5-bromanylpyridine-3-carboxylate Openeye Name: (2-methyl-4-oxo-3-phenyl-chromen-7-yl) 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-methyl-4-oxo-3-phenylchromen-7-yl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (4-keto-2-methyl-3-phenyl-chromen-7-yl) ester Formula: C22H14BrNO4 MolecularWeight: 436.25486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CN=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CN=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H14BrNO4/c1-13-20(14-5-3-2-4-6-14)21(25)18-8-7-17(10-19(18)27-13)28-22(26)15-9-16(23)12-24-11-15/h2-12H,1H3