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

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

Systemtic Name:6-(butanoyloxymethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Openeye Name:6-(butanoyloxymethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name:3,3-dimethyl-7-oxo-6-(1-oxobutoxymethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC Name:6-(butanoyloxymethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Traditional Name:6-(butyryloxymethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Formula: C13H19NO5S
MolecularWeight: 301.35866
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1C2N(C1=O)C(C(S2)(C)C)C(=O)O


Isomeric SMILES

CCCC(=O)OCC1C2N(C1=O)C(C(S2)(C)C)C(=O)O


InChI

InChI=1S/C13H19NO5S/c1-4-5-8(15)19-6-7-10(16)14-9(12(17)18)13(2,3)20-11(7)14/h7,9,11H,4-6H2,1-3H3,(H,17,18)


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