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

Systemtic Name: methyl 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]ethanoate Openeye Name: methyl 2-[2,6-dinitro-4-(trifluoromethyl)anilino]acetate CAS Name: 2-[2,6-dinitro-4-(trifluoromethyl)anilino]acetic acid methyl ester IUPAC Name: methyl 2-[2,6-dinitro-4-(trifluoromethyl)anilino]acetate Traditional Name: 2-[2,6-dinitro-4-(trifluoromethyl)anilino]acetic acid methyl ester Formula: C10H8F3N3O6 MolecularWeight: 323.18223

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H8F3N3O6/c1-22-8(17)4-14-9-6(15(18)19)2-5(10(11,12)13)3-7(9)16(20)21/h2-3,14H,4H2,1H3