6-[1-(oxan-2-yloxy)ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-[1-(oxan-2-yloxy)ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 7-oxo-6-(1-tetrahydropyran-2-yloxyethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-[1-(2-oxanyloxy)ethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-[1-(oxan-2-yloxy)ethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-6-(1-tetrahydropyran-2-yloxyethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C13H16NO5S- MolecularWeight: 298.33484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=CS2)C(=O)[O-])OC3CCCCO3

Isomeric SMILES

CC(C1C2N(C1=O)C(=CS2)C(=O)[O-])OC3CCCCO3

InChI

InChI=1S/C13H17NO5S/c1-7(19-9-4-2-3-5-18-9)10-11(15)14-8(13(16)17)6-20-12(10)14/h6-7,9-10,12H,2-5H2,1H3,(H,16,17)/p-1