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

Systemtic Name: 2-[5-azanyl-3-(2,5-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide Openeye Name: 2-[5-amino-3-(2,5-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[5-amino-3-(2,5-dimethoxyphenyl)-6-oxo-1-pyridazinyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[5-amino-3-(2,5-dimethoxyphenyl)-6-oxopyridazin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[5-amino-3-(2,5-dimethoxyphenyl)-6-keto-pyridazin-1-yl]-N-piperonyl-acetamide Formula: C22H22N4O6 MolecularWeight: 438.43328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN(C(=O)C(=C2)N)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN(C(=O)C(=C2)N)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N4O6/c1-29-14-4-6-18(30-2)15(8-14)17-9-16(23)22(28)26(25-17)11-21(27)24-10-13-3-5-19-20(7-13)32-12-31-19/h3-9H,10-12,23H2,1-2H3,(H,24,27)