(5R,6R)-3-ethylsulfinyl-7-oxidanylidene-6-(2-oxidanylpropan-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (5R,6R)-3-ethylsulfinyl-7-oxidanylidene-6-(2-oxidanylpropan-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: (5R,6R)-3-ethylsulfinyl-6-(1-hydroxy-1-methyl-ethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5R,6R)-3-ethylsulfinyl-6-(2-hydroxypropan-2-yl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: (5R,6R)-3-ethylsulfinyl-6-(2-hydroxypropan-2-yl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5R,6R)-3-ethylsulfinyl-6-(1-hydroxy-1-methyl-ethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C11H14NO5S2- MolecularWeight: 304.36256

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=C(N2C(S1)C(C2=O)C(C)(C)O)C(=O)[O-]

Isomeric SMILES

CCS(=O)C1=C(N2[C@H](S1)[C@@H](C2=O)C(C)(C)O)C(=O)[O-]

InChI

InChI=1S/C11H15NO5S2/c1-4-19(17)10-6(9(14)15)12-7(13)5(8(12)18-10)11(2,3)16/h5,8,16H,4H2,1-3H3,(H,14,15)/p-1/t5-,8-,19?/m1/s1