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

Systemtic Name: 1-(chloromethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 1-(chloromethyl)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 1-(chloromethyl)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 1-(chloromethyl)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 1-(chloromethyl)-7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C9H13ClNO3S+ MolecularWeight: 250.72242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12ClNO3S/c1-9(2)7(8(13)14)11(4-10)5(12)3-6(11)15-9/h6-7H,3-4H2,1-2H3/p+1