(5S,6S)-5-ethyl-3,3-dimethyl-6-propyl-oxane-2,4-dione

Systemtic Name: (5S,6S)-5-ethyl-3,3-dimethyl-6-propyl-oxane-2,4-dione Openeye Name: (5S,6S)-5-ethyl-3,3-dimethyl-6-propyl-tetrahydropyran-2,4-dione CAS Name: (5S,6S)-5-ethyl-3,3-dimethyl-6-propyloxane-2,4-dione IUPAC Name: (5S,6S)-5-ethyl-3,3-dimethyl-6-propyloxane-2,4-dione Traditional Name: (5S,6S)-5-ethyl-3,3-dimethyl-6-propyl-tetrahydropyran-2,4-quinone Formula: C12H20O3 MolecularWeight: 212.2854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=O)C(C(=O)O1)(C)C)CC

Isomeric SMILES

CCC[C@H]1[C@@H](C(=O)C(C(=O)O1)(C)C)CC

InChI

InChI=1S/C12H20O3/c1-5-7-9-8(6-2)10(13)12(3,4)11(14)15-9/h8-9H,5-7H2,1-4H3/t8-,9-/m0/s1