[(E,3S)-4-(4-methoxy-6-oxidanylidene-pyran-2-yl)-4-methyl-3-phenylmethoxy-pent-1-enyl]boronic acid

Systemtic Name: [(E,3S)-4-(4-methoxy-6-oxidanylidene-pyran-2-yl)-4-methyl-3-phenylmethoxy-pent-1-enyl]boronic acid Openeye Name: [(E,3S)-3-benzyloxy-4-(4-methoxy-6-oxo-pyran-2-yl)-4-methyl-pent-1-enyl]boronic acid CAS Name: [(E,3S)-4-(4-methoxy-6-oxo-2-pyranyl)-4-methyl-3-phenylmethoxypent-1-enyl]boronic acid IUPAC Name: [(E,3S)-4-(4-methoxy-6-oxopyran-2-yl)-4-methyl-3-phenylmethoxypent-1-enyl]boronic acid Traditional Name: [(E,3S)-3-benzoxy-4-(6-keto-4-methoxy-pyran-2-yl)-4-methyl-pent-1-enyl]boronic acid Formula: C19H23BO6 MolecularWeight: 358.19332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C=CC(C(C)(C)C1=CC(=CC(=O)O1)OC)OCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(/C=C/[C@@H](C(C)(C)C1=CC(=CC(=O)O1)OC)OCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C19H23BO6/c1-19(2,17-11-15(24-3)12-18(21)26-17)16(9-10-20(22)23)25-13-14-7-5-4-6-8-14/h4-12,16,22-23H,13H2,1-3H3/b10-9+/t16-/m0/s1