(3S,4S)-3,4-dimethyl-5-phenylmethoxy-pentanal

Systemtic Name: (3S,4S)-3,4-dimethyl-5-phenylmethoxy-pentanal Openeye Name: (3S,4S)-5-benzyloxy-3,4-dimethyl-pentanal CAS Name: (3S,4S)-3,4-dimethyl-5-phenylmethoxypentanal IUPAC Name: (3S,4S)-3,4-dimethyl-5-phenylmethoxypentanal Traditional Name: (3S,4S)-5-benzoxy-3,4-dimethyl-valeraldehyde Formula: C14H20O2 MolecularWeight: 220.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O2/c1-12(8-9-15)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