3,3-dimethyl-6-methylidene-2-oxidanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; 2,2-dimethylpropanoic acid

Systemtic Name: 3,3-dimethyl-6-methylidene-2-oxidanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; 2,2-dimethylpropanoic acid Openeye Name: 2,2-dimethylpropanoic acid; 2-hydroxy-3,3-dimethyl-6-methylene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 2,2-dimethylpropanoic acid; 2-hydroxy-3,3-dimethyl-6-methylene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: 2,2-dimethylpropanoic acid; 2-hydroxy-3,3-dimethyl-6-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 2,2-dimethylpropionic acid; 2-hydroxy-7-keto-3,3-dimethyl-6-methylene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C14H20NO6S- MolecularWeight: 330.3767

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(=C)C2=O)(C(=O)[O-])O)C.CC(C)(C)C(=O)O

Isomeric SMILES

CC1(C(N2C(S1)C(=C)C2=O)(C(=O)[O-])O)C.CC(C)(C)C(=O)O

InChI

InChI=1S/C9H11NO4S.C5H10O2/c1-4-5(11)10-6(4)15-8(2,3)9(10,14)7(12)13;1-5(2,3)4(6)7/h6,14H,1H2,2-3H3,(H,12,13);1-3H3,(H,6,7)/p-1