1-[4-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]phenyl]propan-1-one Traditional Name: 1-[4-(2-nitro-4-triflyl-phenoxy)phenyl]propan-1-one Formula: C16H12F3NO6S MolecularWeight: 403.32979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H12F3NO6S/c1-2-14(21)10-3-5-11(6-4-10)26-15-8-7-12(9-13(15)20(22)23)27(24,25)16(17,18)19/h3-9H,2H2,1H3