(phenylmethyl) 3-(acetyloxymethyl)-7-azido-8-oxidanylidene-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (phenylmethyl) 3-(acetyloxymethyl)-7-azido-8-oxidanylidene-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzyl 3-(acetoxymethyl)-7-azido-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(acetyloxymethyl)-7-azido-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(acetyloxymethyl)-7-azido-8-oxo-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(acetoxymethyl)-7-azido-8-keto-4-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzyl ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2C(CO1)C(C2=O)N=[N+]=[N-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OCC1=C(N2C(CO1)C(C2=O)N=[N+]=[N-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O6/c1-10(22)25-9-13-15(17(24)27-7-11-5-3-2-4-6-11)21-12(8-26-13)14(16(21)23)19-20-18/h2-6,12,14H,7-9H2,1H3