[2-methyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propyl] ethanoate

Systemtic Name: [2-methyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propyl] ethanoate Openeye Name: [2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propyl] acetate CAS Name: acetic acid [2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propyl] ester IUPAC Name: [2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propyl] acetate Traditional Name: acetic acid [2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propyl] ester Formula: C13H15F3N2O4 MolecularWeight: 320.26441

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15F3N2O4/c1-8(19)22-7-12(2,3)17-10-5-4-9(13(14,15)16)6-11(10)18(20)21/h4-6,17H,7H2,1-3H3