1-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 1-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 1-amino-7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C8H13N2O3S+ MolecularWeight: 217.26542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12N2O3S/c1-8(2)6(7(12)13)10(9)4(11)3-5(10)14-8/h5-6H,3,9H2,1-2H3/p+1