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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O10S2/c21-19(22)13-4-1-8-17(10-13)31(25,26)29-15-6-3-7-16(12-15)30-32(27,28)18-9-2-5-14(11-18)20(23)24/h1-2,4-5,8-11,15-16H,3,6-7,12H2