(4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane

Systemtic Name: (4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane Openeye Name: (4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane CAS Name: (4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane IUPAC Name: (4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane Traditional Name: (4S,6R)-4-hexyl-6-methyl-2-phenyl-1,3,2-dioxaborinane Formula: C16H25BO2 MolecularWeight: 260.1795

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(OC(CC(O1)CCCCCC)C)C2=CC=CC=C2

Isomeric SMILES

B1(O[C@@H](C[C@@H](O1)CCCCCC)C)C2=CC=CC=C2

InChI

InChI=1S/C16H25BO2/c1-3-4-5-9-12-16-13-14(2)18-17(19-16)15-10-7-6-8-11-15/h6-8,10-11,14,16H,3-5,9,12-13H2,1-2H3/t14-,16+/m1/s1