(1-aminocarbonyl-4-bicyclo[2.2.2]octanyl) 4-nitrobenzenesulfonate

Systemtic Name: (1-aminocarbonyl-4-bicyclo[2.2.2]octanyl) 4-nitrobenzenesulfonate Openeye Name: (1-carbamoyl-4-bicyclo[2.2.2]octanyl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (1-carbamoyl-4-bicyclo[2.2.2]octanyl) ester IUPAC Name: (1-carbamoyl-4-bicyclo[2.2.2]octanyl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (1-carbamoyl-4-bicyclo[2.2.2]octanyl) ester Formula: C15H18N2O6S MolecularWeight: 354.37822

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1(CC2)C(=O)N)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC2(CCC1(CC2)C(=O)N)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6S/c16-13(18)14-5-8-15(9-6-14,10-7-14)23-24(21,22)12-3-1-11(2-4-12)17(19)20/h1-4H,5-10H2,(H2,16,18)