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

Systemtic Name: (2,3,6-trimethylphenyl) 5-bromanylpyridine-3-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (2,3,6-trimethylphenyl) ester Formula: C15H14BrNO2 MolecularWeight: 320.18116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrNO2/c1-9-4-5-10(2)14(11(9)3)19-15(18)12-6-13(16)8-17-7-12/h4-8H,1-3H3