methyl 5-[[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-(1,3-benzodioxol-5-yl)-6-oxo-pyridazin-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3-(1,3-benzodioxol-5-yl)-6-oxo-1-pyridazinyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(1,3-benzodioxol-5-yl)-6-oxopyridazin-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3-(1,3-benzodioxol-5-yl)-6-keto-pyridazin-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C(=O)C=CC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C(=O)C=CC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N2O6/c1-23-18(22)15-6-3-12(26-15)9-20-17(21)7-4-13(19-20)11-2-5-14-16(8-11)25-10-24-14/h2-8H,9-10H2,1H3