2-[5,6-bis(chloranyl)-2-[1,1,1-tris(fluoranyl)-2-oxidanyl-propan-2-yl]benzimidazol-1-yl]ethanenitrile

Systemtic Name: 2-[5,6-bis(chloranyl)-2-[1,1,1-tris(fluoranyl)-2-oxidanyl-propan-2-yl]benzimidazol-1-yl]ethanenitrile Openeye Name: 2-[5,6-dichloro-2-(2,2,2-trifluoro-1-hydroxy-1-methyl-ethyl)benzimidazol-1-yl]acetonitrile CAS Name: 2-[5,6-dichloro-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)-1-benzimidazolyl]acetonitrile IUPAC Name: 2-[5,6-dichloro-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)benzimidazol-1-yl]acetonitrile Traditional Name: 2-[5,6-dichloro-2-(2,2,2-trifluoro-1-hydroxy-1-methyl-ethyl)benzimidazol-1-yl]acetonitrile Formula: C12H8Cl2F3N3O MolecularWeight: 338.11263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC(=C(C=C2N1CC#N)Cl)Cl)(C(F)(F)F)O

Isomeric SMILES

CC(C1=NC2=CC(=C(C=C2N1CC#N)Cl)Cl)(C(F)(F)F)O

InChI

InChI=1S/C12H8Cl2F3N3O/c1-11(21,12(15,16)17)10-19-8-4-6(13)7(14)5-9(8)20(10)3-2-18/h4-5,21H,3H2,1H3