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

Systemtic Name: 8-oxidanylidene-7-(2-phenoxyethanoylamino)-3-(3-phenylprop-2-ynoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-7-[(2-phenoxyacetyl)amino]-3-(3-phenylprop-2-ynoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-3-(3-phenylprop-2-ynoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-7-[(2-phenoxyacetyl)amino]-3-(3-phenylprop-2-ynoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[(2-phenoxyacetyl)amino]-3-(3-phenylprop-2-ynoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C24H20N2O6S MolecularWeight: 464.4904

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)OCC#CC4=CC=CC=C4

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)OCC#CC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O6S/c27-19(14-32-17-11-5-2-6-12-17)25-20-22(28)26-21(24(29)30)18(15-33-23(20)26)31-13-7-10-16-8-3-1-4-9-16/h1-6,8-9,11-12,20,23H,13-15H2,(H,25,27)(H,29,30)