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

Systemtic Name: (E)-3-(2-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(2-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(2-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]sulfonylprop-2-enenitrile Traditional Name: (E)-3-(2-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-acrylonitrile Formula: C16H9F3N2O4S MolecularWeight: 382.31387

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H9F3N2O4S/c17-16(18,19)12-5-7-13(8-6-12)26(24,25)14(10-20)9-11-3-1-2-4-15(11)21(22)23/h1-9H/b14-9+