[3-(4-nitrophenyl)sulfonyloxycyclohexyl] 4-nitrobenzenesulfonate

Systemtic Name: [3-(4-nitrophenyl)sulfonyloxycyclohexyl] 4-nitrobenzenesulfonate Openeye Name: [3-(4-nitrophenyl)sulfonyloxycyclohexyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [3-(4-nitrophenyl)sulfonyloxycyclohexyl] ester IUPAC Name: [3-(4-nitrophenyl)sulfonyloxycyclohexyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (3-nosyloxycyclohexyl) ester Formula: C18H18N2O10S2 MolecularWeight: 486.47292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CC(C1)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O10S2/c21-19(22)13-4-8-17(9-5-13)31(25,26)29-15-2-1-3-16(12-15)30-32(27,28)18-10-6-14(7-11-18)20(23)24/h4-11,15-16H,1-3,12H2