(5-bromanyl-2-methoxy-phenyl)methyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid (5-bromo-2-methoxy-benzyl) ester Formula: C13H13BrN2O4 MolecularWeight: 341.15732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)COC(=O)C2=NNC(=O)CC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)COC(=O)C2=NNC(=O)CC2

InChI

InChI=1S/C13H13BrN2O4/c1-19-11-4-2-9(14)6-8(11)7-20-13(18)10-3-5-12(17)16-15-10/h2,4,6H,3,5,7H2,1H3,(H,16,17)