(6S)-3-methyl-8-oxidanylidene-7-(propanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid

Systemtic Name: (6S)-3-methyl-8-oxidanylidene-7-(propanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Openeye Name: (6S)-3-methyl-8-oxo-7-(propanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid CAS Name: (6S)-3-methyl-8-oxo-7-(1-oxopropylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid IUPAC Name: (6S)-3-methyl-8-oxo-7-(propanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Traditional Name: (6S)-8-keto-3-methyl-7-propionamido-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1C2N(C1=O)C(C(=CS2)C)C(=O)O

Isomeric SMILES

CCC(=O)NC1[C@H]2N(C1=O)C(C(=CS2)C)C(=O)O

InChI

InChI=1S/C11H14N2O4S/c1-3-6(14)12-7-9(15)13-8(11(16)17)5(2)4-18-10(7)13/h4,7-8,10H,3H2,1-2H3,(H,12,14)(H,16,17)/t7?,8?,10-/m0/s1