(E)-3-(4-ethyl-3-nitro-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(4-ethyl-3-nitrophenyl)-2-(4-fluorophenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4-ethyl-3-nitrophenyl)-2-(4-fluorophenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(4-fluorophenyl)sulfonyl-acrylonitrile Formula: C17H13FN2O4S MolecularWeight: 360.359523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13FN2O4S/c1-2-13-4-3-12(10-17(13)20(21)22)9-16(11-19)25(23,24)15-7-5-14(18)6-8-15/h3-10H,2H2,1H3/b16-9+