(4R,5S,6S)-4,6-dimethyl-5-oxidanyl-octan-3-one

Systemtic Name: (4R,5S,6S)-4,6-dimethyl-5-oxidanyl-octan-3-one Openeye Name: (4R,5S,6S)-5-hydroxy-4,6-dimethyl-octan-3-one CAS Name: (4R,5S,6S)-5-hydroxy-4,6-dimethyl-3-octanone IUPAC Name: (4R,5S,6S)-5-hydroxy-4,6-dimethyloctan-3-one Traditional Name: (4R,5S,6S)-5-hydroxy-4,6-dimethyl-octan-3-one Formula: C10H20O2 MolecularWeight: 172.2646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C(=O)CC)O

Isomeric SMILES

CC[C@H](C)[C@@H]([C@@H](C)C(=O)CC)O

InChI

InChI=1S/C10H20O2/c1-5-7(3)10(12)8(4)9(11)6-2/h7-8,10,12H,5-6H2,1-4H3/t7-,8-,10-/m0/s1