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

Systemtic Name: 5-bromanyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: 5-bromo-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 5-bromo-4,6-dimethyl-3-pyridinecarboxylate IUPAC Name: 5-bromo-4,6-dimethylpyridine-3-carboxylate Traditional Name: 5-bromo-4,6-dimethyl-nicotinate Formula: C8H7BrNO2- MolecularWeight: 229.05068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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