ethyl 2-[ethanoyl-[2-nitro-5-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenoxy]phenyl]amino]propanoate

Systemtic Name: ethyl 2-[ethanoyl-[2-nitro-5-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenoxy]phenyl]amino]propanoate Openeye Name: ethyl 2-[N-acetyl-2-nitro-5-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]anilino]propanoate CAS Name: 2-[N-acetyl-2-nitro-5-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]anilino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[N-acetyl-2-nitro-5-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]anilino]propanoate Traditional Name: 2-[N-acetyl-2-nitro-5-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]anilino]propionic acid ethyl ester Formula: C21H20F4N2O7 MolecularWeight: 488.386313

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N(C1=C(C=CC(=C1)OC2=CC=C(C=C2)OC(C(F)F)(F)F)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C(C)N(C1=C(C=CC(=C1)OC2=CC=C(C=C2)OC(C(F)F)(F)F)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C21H20F4N2O7/c1-4-32-19(29)12(2)26(13(3)28)18-11-16(9-10-17(18)27(30)31)33-14-5-7-15(8-6-14)34-21(24,25)20(22)23/h5-12,20H,4H2,1-3H3