(3S,4S)-3-methyl-4-oxidanyl-6-phenyl-hex-5-yn-2-one

Systemtic Name: (3S,4S)-3-methyl-4-oxidanyl-6-phenyl-hex-5-yn-2-one Openeye Name: (3S,4S)-4-hydroxy-3-methyl-6-phenyl-hex-5-yn-2-one CAS Name: (3S,4S)-4-hydroxy-3-methyl-6-phenyl-5-hexyn-2-one IUPAC Name: (3S,4S)-4-hydroxy-3-methyl-6-phenylhex-5-yn-2-one Traditional Name: (3S,4S)-4-hydroxy-3-methyl-6-phenyl-hex-5-yn-2-one Formula: C13H14O2 MolecularWeight: 202.24906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#CC1=CC=CC=C1)O)C(=O)C

Isomeric SMILES

C[C@@H]([C@@H](C#CC1=CC=CC=C1)O)C(=O)C

InChI

InChI=1S/C13H14O2/c1-10(11(2)14)13(15)9-8-12-6-4-3-5-7-12/h3-7,10,13,15H,1-2H3/t10-,13-/m1/s1