[3-oxidanylidene-2-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl] 3,3-dimethylbutanoate

Systemtic Name: [3-oxidanylidene-2-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl] 3,3-dimethylbutanoate Openeye Name: [3-oxo-2-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [3-oxo-2-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl] ester IUPAC Name: [3-oxo-2-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (3-keto-2-mesityl-1,2,5,6,7,8-hexahydropyrazolo[1,2-a]pyridazin-1-yl) ester Formula: C22H32N2O3 MolecularWeight: 372.50108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2C(N3CCCCN3C2=O)OC(=O)CC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2C(N3CCCCN3C2=O)OC(=O)CC(C)(C)C)C

InChI

InChI=1S/C22H32N2O3/c1-14-11-15(2)18(16(3)12-14)19-20(26)23-9-7-8-10-24(23)21(19)27-17(25)13-22(4,5)6/h11-12,19,21H,7-10,13H2,1-6H3