3-methyl-7-oxidanylidene-6-(1-oxidanylpropan-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-methyl-7-oxidanylidene-6-(1-oxidanylpropan-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(2-hydroxy-1-methyl-ethyl)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxypropan-2-yl)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxypropan-2-yl)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(2-hydroxy-1-methyl-ethyl)-7-keto-3-methyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(S1)C(C2=O)C(C)CO)C(=O)O

Isomeric SMILES

CC1=C(N2C(S1)C(C2=O)C(C)CO)C(=O)O

InChI

InChI=1S/C10H13NO4S/c1-4(3-12)6-8(13)11-7(10(14)15)5(2)16-9(6)11/h4,6,9,12H,3H2,1-2H3,(H,14,15)