methyl 1-(1,3-benzodioxol-5-ylmethyl)-5-bromanyl-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-5-bromanyl-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-5-bromo-6-oxo-pyridine-3-carboxylate CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-bromo-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-5-bromo-6-oxopyridine-3-carboxylate Traditional Name: 5-bromo-6-keto-1-piperonyl-nicotinic acid methyl ester Formula: C15H12BrNO5 MolecularWeight: 366.16348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)Br)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)Br)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H12BrNO5/c1-20-15(19)10-5-11(16)14(18)17(7-10)6-9-2-3-12-13(4-9)22-8-21-12/h2-5,7H,6,8H2,1H3