3-oxidanyl-3,3-bis[2-(trifluoromethyl)phenyl]propanenitrile

Systemtic Name: 3-oxidanyl-3,3-bis[2-(trifluoromethyl)phenyl]propanenitrile Openeye Name: 3-hydroxy-3,3-bis[2-(trifluoromethyl)phenyl]propanenitrile CAS Name: 3-hydroxy-3,3-bis[2-(trifluoromethyl)phenyl]propanenitrile IUPAC Name: 3-hydroxy-3,3-bis[2-(trifluoromethyl)phenyl]propanenitrile Traditional Name: 3-hydroxy-3,3-bis[2-(trifluoromethyl)phenyl]propionitrile Formula: C17H11F6NO MolecularWeight: 359.265759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CC#N)(C2=CC=CC=C2C(F)(F)F)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(CC#N)(C2=CC=CC=C2C(F)(F)F)O)C(F)(F)F

InChI

InChI=1S/C17H11F6NO/c18-16(19,20)13-7-3-1-5-11(13)15(25,9-10-24)12-6-2-4-8-14(12)17(21,22)23/h1-8,25H,9H2