1-nitro-3-(4-nitrophenyl)sulfanylsulfonyl-benzene

Systemtic Name: 1-nitro-3-(4-nitrophenyl)sulfanylsulfonyl-benzene Openeye Name: 1-nitro-3-(4-nitrophenyl)sulfanylsulfonyl-benzene CAS Name: 1-nitro-3-[(4-nitrophenyl)thio]sulfonylbenzene IUPAC Name: 1-nitro-3-(4-nitrophenyl)sulfanylsulfonylbenzene Traditional Name: 1-nitro-3-[(4-nitrophenyl)thio]sulfonyl-benzene Formula: C12H8N2O6S2 MolecularWeight: 340.33172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)SC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)SC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O6S2/c15-13(16)9-4-6-11(7-5-9)21-22(19,20)12-3-1-2-10(8-12)14(17)18/h1-8H