ethyl 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-methyl-amino]ethanoate

Systemtic Name: ethyl 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-methyl-amino]ethanoate Openeye Name: ethyl 2-[N-methyl-2,6-dinitro-4-(trifluoromethyl)anilino]acetate CAS Name: 2-[N-methyl-2,6-dinitro-4-(trifluoromethyl)anilino]acetic acid ethyl ester IUPAC Name: ethyl 2-[N-methyl-2,6-dinitro-4-(trifluoromethyl)anilino]acetate Traditional Name: 2-[N-methyl-2,6-dinitro-4-(trifluoromethyl)anilino]acetic acid ethyl ester Formula: C12H12F3N3O6 MolecularWeight: 351.23539

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3N3O6/c1-3-24-10(19)6-16(2)11-8(17(20)21)4-7(12(13,14)15)5-9(11)18(22)23/h4-5H,3,6H2,1-2H3