3,3-dimethyl-7-oxidanylidene-6-(sulfooxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-6-(sulfooxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3,3-dimethyl-7-oxo-6-(sulfooxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-7-oxo-6-(sulfooxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-7-oxo-6-(sulfooxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 7-keto-3,3-dimethyl-6-(sulfoxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C9H13NO7S2 MolecularWeight: 311.33202

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)COS(=O)(=O)O)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)COS(=O)(=O)O)C(=O)O)C

InChI

InChI=1S/C9H13NO7S2/c1-9(2)5(8(12)13)10-6(11)4(7(10)18-9)3-17-19(14,15)16/h4-5,7H,3H2,1-2H3,(H,12,13)(H,14,15,16)