2-[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl]ethyl ethanoate

Systemtic Name: 2-[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl]ethyl ethanoate Openeye Name: 2-[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl]ethyl acetate CAS Name: acetic acid 2-[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl]ethyl ester IUPAC Name: 2-[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl]ethyl acetate Traditional Name: acetic acid 2-(3-nitro-4-triflyloxy-phenyl)ethyl ester Formula: C11H10F3NO7S MolecularWeight: 357.25981

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H10F3NO7S/c1-7(16)21-5-4-8-2-3-10(9(6-8)15(17)18)22-23(19,20)11(12,13)14/h2-3,6H,4-5H2,1H3