(phenylmethyl) 4-oxidanyl-3-(oxidanylideneboranylmethylamino)butanoate

Systemtic Name: (phenylmethyl) 4-oxidanyl-3-(oxidanylideneboranylmethylamino)butanoate Openeye Name: benzyl 4-hydroxy-3-(oxoboranylmethylamino)butanoate CAS Name: 4-hydroxy-3-(oxoboranylmethylamino)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-hydroxy-3-(oxoboranylmethylamino)butanoate Traditional Name: 4-hydroxy-3-(ketoboranylmethylamino)butyric acid benzyl ester Formula: C12H16BNO4 MolecularWeight: 249.07074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(=O)CNC(CC(=O)OCC1=CC=CC=C1)CO

Isomeric SMILES

B(=O)CNC(CC(=O)OCC1=CC=CC=C1)CO

InChI

InChI=1S/C12H16BNO4/c15-7-11(14-9-13-17)6-12(16)18-8-10-4-2-1-3-5-10/h1-5,11,14-15H,6-9H2