3-[6,6-bis(fluoranyl)-3,7-dimethyl-hexadecan-7-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[6,6-bis(fluoranyl)-3,7-dimethyl-hexadecan-7-yl]-1H-pyridazin-6-one Openeye Name: 3-[1-(1,1-difluoro-4-methyl-hexyl)-1-methyl-decyl]-1H-pyridazin-6-one CAS Name: 3-(6,6-difluoro-3,7-dimethylhexadecan-7-yl)-1H-pyridazin-6-one IUPAC Name: 3-(6,6-difluoro-3,7-dimethylhexadecan-7-yl)-1H-pyridazin-6-one Traditional Name: 3-[1-(1,1-difluoro-4-methyl-hexyl)-1-methyl-decyl]-1H-pyridazin-6-one Formula: C22H38F2N2O MolecularWeight: 384.546726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38F2N2O/c1-5-7-8-9-10-11-12-16-21(4,19-13-14-20(27)26-25-19)22(23,24)17-15-18(3)6-2/h13-14,18H,5-12,15-17H2,1-4H3,(H,26,27)