N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-oxo-1-pyridazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethoxyphenyl)-6-keto-pyridazin-1-yl]acetamide Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C21H19N3O6/c1-27-16-6-3-13(9-18(16)28-2)15-5-8-21(26)24(23-15)11-20(25)22-14-4-7-17-19(10-14)30-12-29-17/h3-10H,11-12H2,1-2H3,(H,22,25)