[4-[1-[4-(4-nitrophenyl)sulfonyloxyphenyl]cyclohexyl]phenyl] 4-nitrobenzenesulfonate

Systemtic Name: [4-[1-[4-(4-nitrophenyl)sulfonyloxyphenyl]cyclohexyl]phenyl] 4-nitrobenzenesulfonate Openeye Name: [4-[1-[4-(4-nitrophenyl)sulfonyloxyphenyl]cyclohexyl]phenyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [4-[1-[4-(4-nitrophenyl)sulfonyloxyphenyl]cyclohexyl]phenyl] ester IUPAC Name: [4-[1-[4-(4-nitrophenyl)sulfonyloxyphenyl]cyclohexyl]phenyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [4-[1-(4-nosyloxyphenyl)cyclohexyl]phenyl] ester Formula: C30H26N2O10S2 MolecularWeight: 638.66484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)(C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H26N2O10S2/c33-31(34)24-8-16-28(17-9-24)43(37,38)41-26-12-4-22(5-13-26)30(20-2-1-3-21-30)23-6-14-27(15-7-23)42-44(39,40)29-18-10-25(11-19-29)32(35)36/h4-19H,1-3,20-21H2