3-[9-tert-butyl-18,18,18-tris(fluoranyl)octadecan-9-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[9-tert-butyl-18,18,18-tris(fluoranyl)octadecan-9-yl]-1H-pyridazin-6-one Openeye Name: 3-(1-tert-butyl-10,10,10-trifluoro-1-octyl-decyl)-1H-pyridazin-6-one CAS Name: 3-(9-tert-butyl-18,18,18-trifluorooctadecan-9-yl)-1H-pyridazin-6-one IUPAC Name: 3-(9-tert-butyl-18,18,18-trifluorooctadecan-9-yl)-1H-pyridazin-6-one Traditional Name: 3-(1-tert-butyl-10,10,10-trifluoro-1-octyl-decyl)-1H-pyridazin-6-one Formula: C26H45F3N2O MolecularWeight: 458.64351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCCC(F)(F)F)(C1=NNC(=O)C=C1)C(C)(C)C

Isomeric SMILES

CCCCCCCCC(CCCCCCCCC(F)(F)F)(C1=NNC(=O)C=C1)C(C)(C)C

InChI

InChI=1S/C26H45F3N2O/c1-5-6-7-8-11-14-19-25(24(2,3)4,22-17-18-23(32)31-30-22)20-15-12-9-10-13-16-21-26(27,28)29/h17-18H,5-16,19-21H2,1-4H3,(H,31,32)