sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate

Systemtic Name: sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate Openeye Name: sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate CAS Name: sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate IUPAC Name: sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate Traditional Name: sodium (1S,4R,5R)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-sulfonate Formula: C7H12NNaO3S MolecularWeight: 213.22985

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C1C(NC2)S(=O)(=O)[O-])C.[Na+]

Isomeric SMILES

CC1([C@@H]2[C@H]1[C@H](NC2)S(=O)(=O)[O-])C.[Na+]

InChI

InChI=1S/C7H13NO3S.Na/c1-7(2)4-3-8-6(5(4)7)12(9,10)11;/h4-6,8H,3H2,1-2H3,(H,9,10,11);/q;+1/p-1/t4-,5-,6+;/m0./s1