2-bromanyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: 2-bromanyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: 2-bromo-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-bromo-4,6-dimethyl-3-pyridinecarboxylate IUPAC Name: 2-bromo-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-bromo-4,6-dimethyl-nicotinate Formula: C8H7BrNO2- MolecularWeight: 229.05068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)[O-])Br)C

InChI

InChI=1S/C8H8BrNO2/c1-4-3-5(2)10-7(9)6(4)8(11)12/h3H,1-2H3,(H,11,12)/p-1