4-bromanyl-2,2,3,3,4,4-hexakis(fluoranyl)-1-isocyanato-butan-1-one

Systemtic Name: 4-bromanyl-2,2,3,3,4,4-hexakis(fluoranyl)-1-isocyanato-butan-1-one Openeye Name: 4-bromo-2,2,3,3,4,4-hexafluoro-butanoyl isocyanate CAS Name: 4-bromo-2,2,3,3,4,4-hexafluoro-1-isocyanato-1-butanone IUPAC Name: 4-bromo-2,2,3,3,4,4-hexafluorobutanoyl isocyanate Traditional Name: 4-bromo-2,2,3,3,4,4-hexafluoro-1-isocyanato-butan-1-one Formula: C5BrF6NO2 MolecularWeight: 299.953419

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Descriptors Computed from Structure

Canonical SMILES:

C(=NC(=O)C(C(C(F)(F)Br)(F)F)(F)F)=O

Isomeric SMILES

C(=NC(=O)C(C(C(F)(F)Br)(F)F)(F)F)=O

InChI

InChI=1S/C5BrF6NO2/c6-5(11,12)4(9,10)3(7,8)2(15)13-1-14