(2,6-dimethylphenyl) 5-bromanylpyridine-3-carboxylate

Systemtic Name: (2,6-dimethylphenyl) 5-bromanylpyridine-3-carboxylate Openeye Name: (2,6-dimethylphenyl) 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (2,6-dimethylphenyl) ester Formula: C14H12BrNO2 MolecularWeight: 306.15458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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