bis[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate

Systemtic Name: bis[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate Openeye Name: bis[2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid bis[2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxoethyl] ester IUPAC Name: bis[2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxoethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis[2-keto-2-[4-nitro-2-(trifluoromethyl)anilino]ethyl] ester Formula: C22H14F6N4O10 MolecularWeight: 608.357779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)NC(=O)COC(=O)C=CC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)NC(=O)COC(=O)/C=C/C(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C22H14F6N4O10/c23-21(24,25)13-7-11(31(37)38)1-3-15(13)29-17(33)9-41-19(35)5-6-20(36)42-10-18(34)30-16-4-2-12(32(39)40)8-14(16)22(26,27)28/h1-8H,9-10H2,(H,29,33)(H,30,34)/b6-5+