7-[(E)-2-(2,2-dimethyl-1,2-oxazolidin-2-ium-5-yl)ethenyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[(E)-2-(2,2-dimethyl-1,2-oxazolidin-2-ium-5-yl)ethenyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(E)-2-(2,2-dimethylisoxazolidin-2-ium-5-yl)vinyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[(E)-2-(2,2-dimethyl-5-isoxazolidin-2-iumyl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(E)-2-(2,2-dimethyl-1,2-oxazolidin-2-ium-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[(E)-2-(2,2-dimethylisoxazolidin-2-ium-5-yl)vinyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C14H19N2O4S+ MolecularWeight: 311.37666

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(O1)C=CC2C3N(C2=O)C(=CCS3)C(=O)O)C

Isomeric SMILES

C[N+]1(CCC(O1)/C=C/C2C3N(C2=O)C(=CCS3)C(=O)O)C

InChI

InChI=1S/C14H18N2O4S/c1-16(2)7-5-9(20-16)3-4-10-12(17)15-11(14(18)19)6-8-21-13(10)15/h3-4,6,9-10,13H,5,7-8H2,1-2H3/p+1/b4-3+