[3-nitro-4-(trifluoromethylsulfonyloxy)phenyl] propanoate

Systemtic Name: [3-nitro-4-(trifluoromethylsulfonyloxy)phenyl] propanoate Openeye Name: [3-nitro-4-(trifluoromethylsulfonyloxy)phenyl] propanoate CAS Name: propanoic acid [3-nitro-4-(trifluoromethylsulfonyloxy)phenyl] ester IUPAC Name: [3-nitro-4-(trifluoromethylsulfonyloxy)phenyl] propanoate Traditional Name: propionic acid (3-nitro-4-triflyloxy-phenyl) ester Formula: C10H8F3NO7S MolecularWeight: 343.23323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)OC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H8F3NO7S/c1-2-9(15)20-6-3-4-8(7(5-6)14(16)17)21-22(18,19)10(11,12)13/h3-5H,2H2,1H3