(phenylmethyl) 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylate

Systemtic Name: (phenylmethyl) 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylate Openeye Name: benzyl 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylate CAS Name: 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylate Traditional Name: 4-oxa-1-azoniabicyclo[3.1.0]hexane-1-carboxylic acid benzyl ester Formula: C12H14NO3+ MolecularWeight: 220.24446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2[N+]1(C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1COC2[N+]1(C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C12H14NO3/c14-12(13-6-7-15-11(13)8-13)16-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2/q+1