(6S)-6-phenethyloxane-2,4-dione

Systemtic Name: (6S)-6-phenethyloxane-2,4-dione Openeye Name: (6S)-6-phenethyltetrahydropyran-2,4-dione CAS Name: (6S)-6-phenethyloxane-2,4-dione IUPAC Name: (6S)-6-phenethyloxane-2,4-dione Traditional Name: (6S)-6-phenethyltetrahydropyran-2,4-quinone Formula: C13H14O3 MolecularWeight: 218.24846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)CC1=O)CCC2=CC=CC=C2

Isomeric SMILES

C1[C@@H](OC(=O)CC1=O)CCC2=CC=CC=C2

InChI

InChI=1S/C13H14O3/c14-11-8-12(16-13(15)9-11)7-6-10-4-2-1-3-5-10/h1-5,12H,6-9H2/t12-/m0/s1