4-methylsulfonyl-1-(4-methylsulfonyl-2-nitro-phenoxy)-2-nitro-benzene

Systemtic Name: 4-methylsulfonyl-1-(4-methylsulfonyl-2-nitro-phenoxy)-2-nitro-benzene Openeye Name: 4-methylsulfonyl-1-(4-methylsulfonyl-2-nitro-phenoxy)-2-nitro-benzene CAS Name: 4-methylsulfonyl-1-(4-methylsulfonyl-2-nitrophenoxy)-2-nitrobenzene IUPAC Name: 4-methylsulfonyl-1-(4-methylsulfonyl-2-nitrophenoxy)-2-nitrobenzene Traditional Name: 4-mesyl-1-(4-mesyl-2-nitro-phenoxy)-2-nitro-benzene Formula: C14H12N2O9S2 MolecularWeight: 416.38308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O9S2/c1-26(21,22)9-3-5-13(11(7-9)15(17)18)25-14-6-4-10(27(2,23)24)8-12(14)16(19)20/h3-8H,1-2H3