[2,4,6-tris(bromanyl)phenyl] 2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfinylethanoate

Systemtic Name: [2,4,6-tris(bromanyl)phenyl] 2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfinylethanoate Openeye Name: (2,4,6-tribromophenyl) 2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfinylacetate CAS Name: 2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfinylacetic acid (2,4,6-tribromophenyl) ester IUPAC Name: (2,4,6-tribromophenyl) 2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfinylacetate Traditional Name: 2-(2-nitro-4-triflyl-phenyl)sulfinylacetic acid (2,4,6-tribromophenyl) ester Formula: C15H7Br3F3NO7S2 MolecularWeight: 674.05579

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)[N+](=O)[O-])S(=O)CC(=O)OC2=C(C=C(C=C2Br)Br)Br

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)[N+](=O)[O-])S(=O)CC(=O)OC2=C(C=C(C=C2Br)Br)Br

InChI

InChI=1S/C15H7Br3F3NO7S2/c16-7-3-9(17)14(10(18)4-7)29-13(23)6-30(26)12-2-1-8(5-11(12)22(24)25)31(27,28)15(19,20)21/h1-5H,6H2