(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 5-bromanylpyridine-3-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C20H12BrNO4 MolecularWeight: 410.21758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C20H12BrNO4/c21-15-7-13(9-22-10-15)20(24)25-11-14-8-18(23)26-17-6-5-12-3-1-2-4-16(12)19(14)17/h1-10H,11H2