(2S,4S)-2,4-dimethyl-5-phenylmethoxy-pentanal

Systemtic Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxy-pentanal Openeye Name: (2S,4S)-5-benzyloxy-2,4-dimethyl-pentanal CAS Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxypentanal IUPAC Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxypentanal Traditional Name: (2S,4S)-5-benzoxy-2,4-dimethyl-valeraldehyde Formula: C14H20O2 MolecularWeight: 220.3074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C=O)COCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C[C@H](C)C=O)COCC1=CC=CC=C1

InChI

InChI=1S/C14H20O2/c1-12(9-15)8-13(2)10-16-11-14-6-4-3-5-7-14/h3-7,9,12-13H,8,10-11H2,1-2H3/t12-,13-/m0/s1