methyl 3-bis(fluoranyl)boranyl-4-(2-phenylethanoylamino)benzoate

Systemtic Name: methyl 3-bis(fluoranyl)boranyl-4-(2-phenylethanoylamino)benzoate Openeye Name: methyl 3-difluoroboranyl-4-[(2-phenylacetyl)amino]benzoate CAS Name: 3-difluoroboranyl-4-[(1-oxo-2-phenylethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-difluoroboranyl-4-[(2-phenylacetyl)amino]benzoate Traditional Name: 3-difluoroboranyl-4-[(2-phenylacetyl)amino]benzoic acid methyl ester Formula: C16H14BF2NO3 MolecularWeight: 317.095066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=CC(=C1)C(=O)OC)NC(=O)CC2=CC=CC=C2)(F)F

Isomeric SMILES

B(C1=C(C=CC(=C1)C(=O)OC)NC(=O)CC2=CC=CC=C2)(F)F

InChI

InChI=1S/C16H14BF2NO3/c1-23-16(22)12-7-8-14(13(10-12)17(18)19)20-15(21)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,20,21)