8-oxidanylidene-4-(pyridin-3-yloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 8-oxidanylidene-4-(pyridin-3-yloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 8-oxo-4-(3-pyridyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-4-(3-pyridinyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 8-oxo-4-(pyridin-3-yloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-4-(3-pyridyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C13H11N2O4S- MolecularWeight: 291.30244

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=CC(S2)COC3=CN=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C2N(C1=O)C(=CC(S2)COC3=CN=CC=C3)C(=O)[O-]

InChI

InChI=1S/C13H12N2O4S/c16-11-5-12-15(11)10(13(17)18)4-9(20-12)7-19-8-2-1-3-14-6-8/h1-4,6,9,12H,5,7H2,(H,17,18)/p-1