potassium 6-(1-hydroxyethyl)-3-(3-methylsulfinylphenyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: potassium 6-(1-hydroxyethyl)-3-(3-methylsulfinylphenyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: potassium 6-(1-hydroxyethyl)-3-(3-methylsulfinylphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: potassium 6-(1-hydroxyethyl)-3-(3-methylsulfinylphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: potassium 6-(1-hydroxyethyl)-3-(3-methylsulfinylphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: potassium 6-(1-hydroxyethyl)-7-keto-3-(3-methylsulfinylphenyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C15H14KNO5S2 MolecularWeight: 391.50366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)C3=CC(=CC=C3)S(=O)C)C(=O)[O-])O.[K+]

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)C3=CC(=CC=C3)S(=O)C)C(=O)[O-])O.[K+]

InChI

InChI=1S/C15H15NO5S2.K/c1-7(17)10-13(18)16-11(15(19)20)12(22-14(10)16)8-4-3-5-9(6-8)23(2)21;/h3-7,10,14,17H,1-2H3,(H,19,20);/q;+1/p-1