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

Systemtic Name: 3-bromanyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-bromo-8-oxo-7-[(2-phenoxyacetyl)amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-bromo-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-bromo-8-oxo-7-[(2-phenoxyacetyl)amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-bromo-8-keto-7-[(2-phenoxyacetyl)amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H15BrN2O5 MolecularWeight: 395.2047

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(N2C1C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)Br

Isomeric SMILES

C1CC(=C(N2C1C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)Br

InChI

InChI=1S/C16H15BrN2O5/c17-10-6-7-11-13(15(21)19(11)14(10)16(22)23)18-12(20)8-24-9-4-2-1-3-5-9/h1-5,11,13H,6-8H2,(H,18,20)(H,22,23)