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

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-pyridazin-1-yl]-N-(4-isopropylphenyl)acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-1-pyridazinyl]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxopyridazin-1-yl]-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6-keto-pyridazin-1-yl]-N-p-cumenyl-acetamide Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4/c1-14(2)15-3-6-17(7-4-15)23-21(26)12-25-22(27)10-8-18(24-25)16-5-9-19-20(11-16)29-13-28-19/h3-11,14H,12-13H2,1-2H3,(H,23,26)