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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[3-(3,4-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[3-(3,4-dimethoxyphenyl)-6-oxo-1-pyridazinyl]butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]butanamide Traditional Name: 4-[3-(3,4-dimethoxyphenyl)-6-keto-pyridazin-1-yl]-N-piperonyl-butyramide Formula: C24H25N3O6 MolecularWeight: 451.4718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O6/c1-30-19-9-6-17(13-21(19)31-2)18-7-10-24(29)27(26-18)11-3-4-23(28)25-14-16-5-8-20-22(12-16)33-15-32-20/h5-10,12-13H,3-4,11,14-15H2,1-2H3,(H,25,28)