(3,5-dimethylphenyl) 5-bromanylpyridine-3-carboxylate

Systemtic Name: (3,5-dimethylphenyl) 5-bromanylpyridine-3-carboxylate Openeye Name: (3,5-dimethylphenyl) 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (3,5-dimethylphenyl) ester Formula: C14H12BrNO2 MolecularWeight: 306.15458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=CC(=CN=C2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=CC(=CN=C2)Br)C

InChI

InChI=1S/C14H12BrNO2/c1-9-3-10(2)5-13(4-9)18-14(17)11-6-12(15)8-16-7-11/h3-8H,1-2H3