7-(2-ethylsulfonylethanoylamino)-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-(2-ethylsulfonylethanoylamino)-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(2-ethylsulfonylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[(2-ethylsulfonyl-1-oxoethyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(2-ethylsulfonylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[(2-esylacetyl)amino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H16N2O6S2 MolecularWeight: 348.39524

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC(=O)NC1C2N(C1=O)C(=C(CS2)C)C(=O)O

Isomeric SMILES

CCS(=O)(=O)CC(=O)NC1C2N(C1=O)C(=C(CS2)C)C(=O)O

InChI

InChI=1S/C12H16N2O6S2/c1-3-22(19,20)5-7(15)13-8-10(16)14-9(12(17)18)6(2)4-21-11(8)14/h8,11H,3-5H2,1-2H3,(H,13,15)(H,17,18)