[2-methyl-1-[[4-nitro-3-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] ethanoate

Systemtic Name: [2-methyl-1-[[4-nitro-3-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] ethanoate Openeye Name: [1,1-dimethyl-2-[4-nitro-3-(trifluoromethyl)anilino]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-methyl-1-[4-nitro-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [2-methyl-1-[4-nitro-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl] acetate Traditional Name: acetic acid [2-keto-1,1-dimethyl-2-[4-nitro-3-(trifluoromethyl)anilino]ethyl] ester Formula: C13H13F3N2O5 MolecularWeight: 334.24793

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC(=O)OC(C)(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H13F3N2O5/c1-7(19)23-12(2,3)11(20)17-8-4-5-10(18(21)22)9(6-8)13(14,15)16/h4-6H,1-3H3,(H,17,20)