methyl 5-bromanyl-1-[2-(cyclohexen-1-yl)ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-bromanyl-1-[2-(cyclohexen-1-yl)ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-bromo-1-[2-(cyclohexen-1-yl)ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-bromo-1-[2-(1-cyclohexenyl)ethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-1-[2-(cyclohexen-1-yl)ethyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-bromo-1-[2-(cyclohexen-1-yl)ethyl]-6-keto-nicotinic acid methyl ester Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)Br)CCC2=CCCCC2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)Br)CCC2=CCCCC2

InChI

InChI=1S/C15H18BrNO3/c1-20-15(19)12-9-13(16)14(18)17(10-12)8-7-11-5-3-2-4-6-11/h5,9-10H,2-4,6-8H2,1H3