3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Openeye Name: 3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid CAS Name: 3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid IUPAC Name: 3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Traditional Name: 7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Formula: C8H12NO3S+ MolecularWeight: 202.25078

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[N+]2(C(S1)CC2=O)C(=O)O)C

Isomeric SMILES

CC1(C[N+]2(C(S1)CC2=O)C(=O)O)C

InChI

InChI=1S/C8H11NO3S/c1-8(2)4-9(7(11)12)5(10)3-6(9)13-8/h6H,3-4H2,1-2H3/p+1