(E)-2-propan-2-ylsulfonyl-3-[2-(trifluoromethyloxy)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-propan-2-ylsulfonyl-3-[2-(trifluoromethyloxy)phenyl]prop-2-enenitrile Openeye Name: (E)-2-isopropylsulfonyl-3-[2-(trifluoromethoxy)phenyl]prop-2-enenitrile CAS Name: (E)-2-propan-2-ylsulfonyl-3-[2-(trifluoromethoxy)phenyl]-2-propenenitrile IUPAC Name: (E)-2-propan-2-ylsulfonyl-3-[2-(trifluoromethoxy)phenyl]prop-2-enenitrile Traditional Name: (E)-2-isopropylsulfonyl-3-[2-(trifluoromethoxy)phenyl]acrylonitrile Formula: C13H12F3NO3S MolecularWeight: 319.29949

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(=CC1=CC=CC=C1OC(F)(F)F)C#N

Isomeric SMILES

CC(C)S(=O)(=O)/C(=C/C1=CC=CC=C1OC(F)(F)F)/C#N

InChI

InChI=1S/C13H12F3NO3S/c1-9(2)21(18,19)11(8-17)7-10-5-3-4-6-12(10)20-13(14,15)16/h3-7,9H,1-2H3/b11-7+