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[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-morpholin-4-yl-3-nitro-benzoate

[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name:[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-morpholin-4-yl-3-nitro-benzoate
Openeye Name:[2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxo-ethyl] 4-morpholino-3-nitro-benzoate
CAS Name:4-(4-morpholinyl)-3-nitrobenzoic acid [2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxoethyl] ester
IUPAC Name:[2-[4-nitro-2-(trifluoromethyl)anilino]-2-oxoethyl] 4-morpholin-4-yl-3-nitrobenzoate
Traditional Name:4-morpholino-3-nitro-benzoic acid [2-keto-2-[4-nitro-2-(trifluoromethyl)anilino]ethyl] ester
Formula: C20H17F3N4O8
MolecularWeight: 498.36619
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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C20H17F3N4O8/c21-20(22,23)14-10-13(26(30)31)2-3-15(14)24-18(28)11-35-19(29)12-1-4-16(17(9-12)27(32)33)25-5-7-34-8-6-25/h1-4,9-10H,5-8,11H2,(H,24,28)


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