(E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonylprop-2-enenitrile Traditional Name: (E)-3-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butylsulfonyl-acrylonitrile Formula: C15H13F6NO2S MolecularWeight: 385.324639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C(=CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC(C)(C)S(=O)(=O)/C(=C/C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)/C#N

InChI

InChI=1S/C15H13F6NO2S/c1-13(2,3)25(23,24)12(8-22)6-9-4-10(14(16,17)18)7-11(5-9)15(19,20)21/h4-7H,1-3H3/b12-6+