(E)-2-(4-tert-butylphenyl)-3-oxidanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-tert-butylphenyl)-3-oxidanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(4-tert-butylphenyl)-3-hydroxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-(4-tert-butylphenyl)-3-hydroxy-3-[2-(trifluoromethyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-tert-butylphenyl)-3-hydroxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(4-tert-butylphenyl)-3-hydroxy-3-[2-(trifluoromethyl)phenyl]acrylonitrile Formula: C20H18F3NO MolecularWeight: 345.35823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18F3NO/c1-19(2,3)14-10-8-13(9-11-14)16(12-24)18(25)15-6-4-5-7-17(15)20(21,22)23/h4-11,25H,1-3H3/b18-16-