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

Systemtic Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6-keto-pyridazin-1-yl]acetic acid methyl ester Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C=CC(=N1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)CN1C(=O)C=CC(=N1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H12N2O5/c1-19-14(18)7-16-13(17)5-3-10(15-16)9-2-4-11-12(6-9)21-8-20-11/h2-6H,7-8H2,1H3