3-[(2R)-2-acetamido-2-(dihydroxyboranyl)ethyl]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[(2R)-2-acetamido-2-(dihydroxyboranyl)ethyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[(2R)-2-acetamido-2-borono-ethyl]-2-hydroxy-benzoic acid CAS Name: 3-[(2R)-2-acetamido-2-boronoethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[(2R)-2-acetamido-2-boronoethyl]-2-hydroxybenzoic acid Traditional Name: 3-[(2R)-2-acetamido-2-borono-ethyl]-2-hydroxy-benzoic acid Formula: C11H14BNO6 MolecularWeight: 267.04296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C(CC1=CC=CC(=C1O)C(=O)O)NC(=O)C)(O)O

Isomeric SMILES

B([C@H](CC1=CC=CC(=C1O)C(=O)O)NC(=O)C)(O)O

InChI

InChI=1S/C11H14BNO6/c1-6(14)13-9(12(18)19)5-7-3-2-4-8(10(7)15)11(16)17/h2-4,9,15,18-19H,5H2,1H3,(H,13,14)(H,16,17)/t9-/m0/s1