(3R,4S,5S)-3-bromanyl-3-methyl-4-oxidanyl-5-(phenylmethyl)oxan-2-one

Systemtic Name: (3R,4S,5S)-3-bromanyl-3-methyl-4-oxidanyl-5-(phenylmethyl)oxan-2-one Openeye Name: (3R,4S,5S)-5-benzyl-3-bromo-4-hydroxy-3-methyl-tetrahydropyran-2-one CAS Name: (3R,4S,5S)-3-bromo-4-hydroxy-3-methyl-5-(phenylmethyl)-2-oxanone IUPAC Name: (3R,4S,5S)-5-benzyl-3-bromo-4-hydroxy-3-methyloxan-2-one Traditional Name: (3R,4S,5S)-5-benzyl-3-bromo-4-hydroxy-3-methyl-tetrahydropyran-2-one Formula: C13H15BrO3 MolecularWeight: 299.1604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(COC1=O)CC2=CC=CC=C2)O)Br

Isomeric SMILES

C[C@]1([C@H]([C@H](COC1=O)CC2=CC=CC=C2)O)Br

InChI

InChI=1S/C13H15BrO3/c1-13(14)11(15)10(8-17-12(13)16)7-9-5-3-2-4-6-9/h2-6,10-11,15H,7-8H2,1H3/t10-,11-,13+/m0/s1