(2S,4S)-2-methyl-4-phenylmethoxy-pentanal

Systemtic Name: (2S,4S)-2-methyl-4-phenylmethoxy-pentanal Openeye Name: (2S,4S)-4-benzyloxy-2-methyl-pentanal CAS Name: (2S,4S)-2-methyl-4-phenylmethoxypentanal IUPAC Name: (2S,4S)-2-methyl-4-phenylmethoxypentanal Traditional Name: (2S,4S)-4-benzoxy-2-methyl-valeraldehyde Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)OCC1=CC=CC=C1)C=O

Isomeric SMILES

C[C@@H](C[C@H](C)OCC1=CC=CC=C1)C=O

InChI

InChI=1S/C13H18O2/c1-11(9-14)8-12(2)15-10-13-6-4-3-5-7-13/h3-7,9,11-12H,8,10H2,1-2H3/t11-,12-/m0/s1