[2,4,6-tris(chloranyl)phenyl] 2-(4-methylsulfonyl-2-nitro-phenyl)sulfinylethanoate

Systemtic Name: [2,4,6-tris(chloranyl)phenyl] 2-(4-methylsulfonyl-2-nitro-phenyl)sulfinylethanoate Openeye Name: (2,4,6-trichlorophenyl) 2-(4-methylsulfonyl-2-nitro-phenyl)sulfinylacetate CAS Name: 2-(4-methylsulfonyl-2-nitrophenyl)sulfinylacetic acid (2,4,6-trichlorophenyl) ester IUPAC Name: (2,4,6-trichlorophenyl) 2-(4-methylsulfonyl-2-nitrophenyl)sulfinylacetate Traditional Name: 2-(4-mesyl-2-nitro-phenyl)sulfinylacetic acid (2,4,6-trichlorophenyl) ester Formula: C15H10Cl3NO7S2 MolecularWeight: 486.7314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)S(=O)CC(=O)OC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)S(=O)CC(=O)OC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H10Cl3NO7S2/c1-28(24,25)9-2-3-13(12(6-9)19(21)22)27(23)7-14(20)26-15-10(17)4-8(16)5-11(15)18/h2-6H,7H2,1H3