[(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] ethanoate

Systemtic Name: [(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] ethanoate Openeye Name: [(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] acetate CAS Name: acetic acid [(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] ester IUPAC Name: [(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] acetate Traditional Name: acetic acid [(1R)-2-methyl-2-nitro-1-[4-(trifluoromethyl)phenyl]propyl] ester Formula: C13H14F3NO4 MolecularWeight: 305.24977

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)O[C@H](C1=CC=C(C=C1)C(F)(F)F)C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C13H14F3NO4/c1-8(18)21-11(12(2,3)17(19)20)9-4-6-10(7-5-9)13(14,15)16/h4-7,11H,1-3H3/t11-/m1/s1