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

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C14H15BrN2O5 MolecularWeight: 371.1833

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15BrN2O5/c1-20-11-5-8(9(15)6-12(11)21-2)7-22-14(19)10-3-4-13(18)17-16-10/h5-6H,3-4,7H2,1-2H3,(H,17,18)