3-(4-methylsulfanylphenoxy)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(4-methylsulfanylphenoxy)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(4-methylsulfanylphenoxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[4-(methylthio)phenoxy]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(4-methylsulfanylphenoxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-3-[4-(methylthio)phenoxy]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C13H11NO4S2 MolecularWeight: 309.36074

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC2=C(N3C(S2)CC3=O)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)OC2=C(N3C(S2)CC3=O)C(=O)O

InChI

InChI=1S/C13H11NO4S2/c1-19-8-4-2-7(3-5-8)18-13-11(12(16)17)14-9(15)6-10(14)20-13/h2-5,10H,6H2,1H3,(H,16,17)