[4-[(E)-2-CYANO-3-(2-FLUORO-5-NITROANILINO)-3-OXOPROP-1-ENYL]PHENYL] 3-NITROBENZOATE

pro_cas
pro_cdbregno
CCD08141280
pro_formula
C23 H13 F N4 O7
pro_molWeight
476.375

basic_info

Product_Name: [4-[(E)-2-CYANO-3-(2-FLUORO-5-NITROANILINO)-3-OXOPROP-1-ENYL]PHENYL] 3-NITROBENZOATE
EnglishSynonyms: [4-[(E)-2-CYANO-3-(2-FLUORO-5-NITROANILINO)-3-OXOPROP-1-ENYL]PHENYL] 3-NITROBENZOATE
pro_mdlNumber: MFCD02225247
pro_acceptors: 11
pro_donors: 1
pro_smile: c1cc(cc(c1)[N+](=O)[O-])C(=O)Oc2ccc(cc2)/C=C(\C#N)/C(=O)Nc3cc(ccc3F)[N+](=O)[O-]
InChi: InChI=1S/C23H13FN4O7/c24-20-9-6-18(28(33)34)12-21(20)26-22(29)16(13-25)10-14-4-7-19(8-5-14)35-23(30)15-2-1-3-17(11-15)27(31)32/h1-12H,(H,26,29)/b16-10+
InChiKey: InChIKey=SWUQHNXZNIBSQV-MHWRWJLKSA-N

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