1-(2-bromanyl-5-methylsulfonyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-(2-bromanyl-5-methylsulfonyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Openeye Name: 1-(2-bromo-5-methylsulfonyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-(2-bromo-5-methylsulfonylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine IUPAC Name: 1-(2-bromo-5-methylsulfonylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-(2-bromo-5-mesyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Formula: C17H18BrN3O6S2 MolecularWeight: 504.37532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18BrN3O6S2/c1-28(24,25)15-6-7-16(18)17(12-15)29(26,27)20-10-8-19(9-11-20)13-2-4-14(5-3-13)21(22)23/h2-7,12H,8-11H2,1H3