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

Systemtic Name: 3-[acetyloxy-(2-phenoxyethanoylamino)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-[acetoxy-[(2-phenoxyacetyl)amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-[acetyloxy-[(1-oxo-2-phenoxyethyl)amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-[acetyloxy-[(2-phenoxyacetyl)amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-[acetoxy-[(2-phenoxyacetyl)amino]methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=C(N2C(CC2=O)SC1)C(=O)O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC(C1=C(N2C(CC2=O)SC1)C(=O)O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O7S/c1-10(21)27-17(19-13(22)8-26-11-5-3-2-4-6-11)12-9-28-15-7-14(23)20(15)16(12)18(24)25/h2-6,15,17H,7-9H2,1H3,(H,19,22)(H,24,25)