methyl 5-bromanyl-6-oxidanylidene-1-propan-2-yl-pyridine-3-carboxylate

Systemtic Name: methyl 5-bromanyl-6-oxidanylidene-1-propan-2-yl-pyridine-3-carboxylate Openeye Name: methyl 5-bromo-1-isopropyl-6-oxo-pyridine-3-carboxylate CAS Name: 5-bromo-6-oxo-1-propan-2-yl-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-6-oxo-1-propan-2-ylpyridine-3-carboxylate Traditional Name: 5-bromo-1-isopropyl-6-keto-nicotinic acid methyl ester Formula: C10H12BrNO3 MolecularWeight: 274.11118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C(C1=O)Br)C(=O)OC

Isomeric SMILES

CC(C)N1C=C(C=C(C1=O)Br)C(=O)OC

InChI

InChI=1S/C10H12BrNO3/c1-6(2)12-5-7(10(14)15-3)4-8(11)9(12)13/h4-6H,1-3H3