8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-3-(trifluoromethylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-3-(trifluoromethylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 8-oxo-7-[[2-(2-thienyl)acetyl]amino]-3-(trifluoromethylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-(trifluoromethylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-3-(trifluoromethylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-[[2-(2-thienyl)acetyl]amino]-3-triflyloxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C14H10F3N2O7S3- MolecularWeight: 471.42861

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-])OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-])OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H11F3N2O7S3/c15-14(16,17)29(24,25)26-7-5-28-12-9(11(21)19(12)10(7)13(22)23)18-8(20)4-6-2-1-3-27-6/h1-3,9,12H,4-5H2,(H,18,20)(H,22,23)/p-1