3-(2-azanylethylsulfanyl)-7-oxidanylidene-6-(2-oxidanylpropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-(2-azanylethylsulfanyl)-7-oxidanylidene-6-(2-oxidanylpropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(2-aminoethylsulfanyl)-6-(1-hydroxy-1-methyl-ethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(2-aminoethylthio)-6-(2-hydroxypropan-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-(2-aminoethylsulfanyl)-6-(2-hydroxypropan-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(2-aminoethylthio)-6-(1-hydroxy-1-methyl-ethyl)-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C12H17N2O4S- MolecularWeight: 285.33938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C2CC(=C(N2C1=O)C(=O)[O-])SCCN)O

Isomeric SMILES

CC(C)(C1C2CC(=C(N2C1=O)C(=O)[O-])SCCN)O

InChI

InChI=1S/C12H18N2O4S/c1-12(2,18)8-6-5-7(19-4-3-13)9(11(16)17)14(6)10(8)15/h6,8,18H,3-5,13H2,1-2H3,(H,16,17)/p-1