(E)-3-[(4-fluoranyl-3-nitro-phenyl)amino]-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[(4-fluoranyl-3-nitro-phenyl)amino]-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-fluoro-3-nitro-anilino)-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(4-fluoro-3-nitroanilino)-2-(4-methoxyphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4-fluoro-3-nitroanilino)-2-(4-methoxyphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-fluoro-3-nitro-anilino)-2-(4-methoxyphenyl)sulfonyl-acrylonitrile Formula: C16H12FN3O5S MolecularWeight: 377.346983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC(=C(C=C2)F)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=CC(=C(C=C2)F)[N+](=O)[O-])/C#N

InChI

InChI=1S/C16H12FN3O5S/c1-25-12-3-5-13(6-4-12)26(23,24)14(9-18)10-19-11-2-7-15(17)16(8-11)20(21)22/h2-8,10,19H,1H3/b14-10+