8-oxidanylidene-3-(5-oxidanylideneoxolan-2-yl)-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-3-(5-oxidanylideneoxolan-2-yl)-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-3-(5-oxotetrahydrofuran-2-yl)-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-3-(5-oxo-2-oxolanyl)-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-3-(5-oxooxolan-2-yl)-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-3-(5-ketotetrahydrofuran-2-yl)-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C19H18N2O7S MolecularWeight: 418.42042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OC1C2=C(N3C(C(C3=O)NC(=O)COC4=CC=CC=C4)SC2)C(=O)O

Isomeric SMILES

C1CC(=O)OC1C2=C(N3C(C(C3=O)NC(=O)COC4=CC=CC=C4)SC2)C(=O)O

InChI

InChI=1S/C19H18N2O7S/c22-13(8-27-10-4-2-1-3-5-10)20-15-17(24)21-16(19(25)26)11(9-29-18(15)21)12-6-7-14(23)28-12/h1-5,12,15,18H,6-9H2,(H,20,22)(H,25,26)