ethyl (E)-2-nitroso-3-[2-[2-nitro-4-(trifluoromethyl)phenyl]hydrazinyl]but-2-enoate

Systemtic Name: ethyl (E)-2-nitroso-3-[2-[2-nitro-4-(trifluoromethyl)phenyl]hydrazinyl]but-2-enoate Openeye Name: ethyl (E)-2-nitroso-3-[2-[2-nitro-4-(trifluoromethyl)phenyl]hydrazino]but-2-enoate CAS Name: (E)-2-nitroso-3-[[2-nitro-4-(trifluoromethyl)phenyl]hydrazo]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-nitroso-3-[2-[2-nitro-4-(trifluoromethyl)phenyl]hydrazinyl]but-2-enoate Traditional Name: (E)-2-nitroso-3-[N'-[2-nitro-4-(trifluoromethyl)phenyl]hydrazino]but-2-enoic acid ethyl ester Formula: C13H13F3N4O5 MolecularWeight: 362.26133

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)NNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])N=O

Isomeric SMILES

CCOC(=O)/C(=C(/C)\NNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])/N=O

InChI

InChI=1S/C13H13F3N4O5/c1-3-25-12(21)11(19-22)7(2)17-18-9-5-4-8(13(14,15)16)6-10(9)20(23)24/h4-6,17-18H,3H2,1-2H3/b11-7+