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

Systemtic Name: 8-oxidanylidene-7-(2-phenoxyethanoylamino)-3-(phenylmethoxycarbamoyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(benzyloxycarbamoyl)-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-3-[oxo-(phenylmethoxyamino)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-7-[(2-phenoxyacetyl)amino]-3-(phenylmethoxycarbamoyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(benzoxycarbamoyl)-8-keto-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C23H21N3O7S MolecularWeight: 483.49374

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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)C(=O)NOCC4=CC=CC=C4

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)C(=O)NOCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O7S/c27-17(12-32-15-9-5-2-6-10-15)24-18-21(29)26-19(23(30)31)16(13-34-22(18)26)20(28)25-33-11-14-7-3-1-4-8-14/h1-10,18,22H,11-13H2,(H,24,27)(H,25,28)(H,30,31)