ethyl (E)-2-[3-[bis(fluoranyl)methoxy]-2,4,5-tris(fluoranyl)-6-nitro-phenyl]carbonyl-3-ethoxy-prop-2-enoate

Systemtic Name: ethyl (E)-2-[3-[bis(fluoranyl)methoxy]-2,4,5-tris(fluoranyl)-6-nitro-phenyl]carbonyl-3-ethoxy-prop-2-enoate Openeye Name: ethyl (E)-2-[3-(difluoromethoxy)-2,4,5-trifluoro-6-nitro-benzoyl]-3-ethoxy-prop-2-enoate CAS Name: (E)-2-[[3-(difluoromethoxy)-2,4,5-trifluoro-6-nitrophenyl]-oxomethyl]-3-ethoxy-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-[3-(difluoromethoxy)-2,4,5-trifluoro-6-nitrobenzoyl]-3-ethoxyprop-2-enoate Traditional Name: (E)-2-[3-(difluoromethoxy)-2,4,5-trifluoro-6-nitro-benzoyl]-3-ethoxy-acrylic acid ethyl ester Formula: C15H12F5NO7 MolecularWeight: 413.250296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C(=O)C1=C(C(=C(C(=C1F)OC(F)F)F)F)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCO/C=C(\C(=O)C1=C(C(=C(C(=C1F)OC(F)F)F)F)[N+](=O)[O-])/C(=O)OCC

InChI

InChI=1S/C15H12F5NO7/c1-3-26-5-6(14(23)27-4-2)12(22)7-8(16)13(28-15(19)20)10(18)9(17)11(7)21(24)25/h5,15H,3-4H2,1-2H3/b6-5+