3-[3-ethyl-5-propan-2-yl-8-(trifluoromethyl)undecan-5-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-ethyl-5-propan-2-yl-8-(trifluoromethyl)undecan-5-yl]-1H-pyridazin-6-one Openeye Name: 3-[1-(2-ethylbutyl)-1-isopropyl-4-(trifluoromethyl)heptyl]-1H-pyridazin-6-one CAS Name: 3-[3-ethyl-5-propan-2-yl-8-(trifluoromethyl)undecan-5-yl]-1H-pyridazin-6-one IUPAC Name: 3-[3-ethyl-5-propan-2-yl-8-(trifluoromethyl)undecan-5-yl]-1H-pyridazin-6-one Traditional Name: 3-[1-(2-ethylbutyl)-1-isopropyl-4-(trifluoromethyl)heptyl]-1H-pyridazin-6-one Formula: C21H35F3N2O MolecularWeight: 388.51061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(CC(CC)CC)(C1=NNC(=O)C=C1)C(C)C)C(F)(F)F

Isomeric SMILES

CCCC(CCC(CC(CC)CC)(C1=NNC(=O)C=C1)C(C)C)C(F)(F)F

InChI

InChI=1S/C21H35F3N2O/c1-6-9-17(21(22,23)24)12-13-20(15(4)5,14-16(7-2)8-3)18-10-11-19(27)26-25-18/h10-11,15-17H,6-9,12-14H2,1-5H3,(H,26,27)