3-[1,1,2-tris(bromanyl)-5-butan-2-yl-7-fluoranyl-undecan-5-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[1,1,2-tris(bromanyl)-5-butan-2-yl-7-fluoranyl-undecan-5-yl]-1H-pyridazin-6-one Openeye Name: 3-[3-fluoro-1-sec-butyl-1-(3,4,4-tribromobutyl)heptyl]-1H-pyridazin-6-one CAS Name: 3-(1,1,2-tribromo-5-butan-2-yl-7-fluoroundecan-5-yl)-1H-pyridazin-6-one IUPAC Name: 3-(1,1,2-tribromo-5-butan-2-yl-7-fluoroundecan-5-yl)-1H-pyridazin-6-one Traditional Name: 3-[3-fluoro-1-sec-butyl-1-(3,4,4-tribromobutyl)heptyl]-1H-pyridazin-6-one Formula: C19H30Br3FN2O MolecularWeight: 561.164703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CCC(C(Br)Br)Br)(C1=NNC(=O)C=C1)C(C)CC)F

Isomeric SMILES

CCCCC(CC(CCC(C(Br)Br)Br)(C1=NNC(=O)C=C1)C(C)CC)F

InChI

InChI=1S/C19H30Br3FN2O/c1-4-6-7-14(23)12-19(13(3)5-2,11-10-15(20)18(21)22)16-8-9-17(26)25-24-16/h8-9,13-15,18H,4-7,10-12H2,1-3H3,(H,25,26)