(E)-3-(3-ethoxy-4-oxidanyl-phenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-ethoxy-4-oxidanyl-phenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-ethoxy-4-hydroxy-phenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3-ethoxy-4-hydroxyphenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3-ethoxy-4-hydroxyphenyl)-2-[4-(trifluoromethyl)phenyl]sulfonylprop-2-enenitrile Traditional Name: (E)-3-(3-ethoxy-4-hydroxy-phenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-acrylonitrile Formula: C18H14F3NO4S MolecularWeight: 397.36827

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)O

InChI

InChI=1S/C18H14F3NO4S/c1-2-26-17-10-12(3-8-16(17)23)9-15(11-22)27(24,25)14-6-4-13(5-7-14)18(19,20)21/h3-10,23H,2H2,1H3/b15-9+