(4S,5S)-4,6-dimethyl-5-phenylmethoxy-heptanal

Systemtic Name: (4S,5S)-4,6-dimethyl-5-phenylmethoxy-heptanal Openeye Name: (4S,5S)-5-benzyloxy-4,6-dimethyl-heptanal CAS Name: (4S,5S)-4,6-dimethyl-5-phenylmethoxyheptanal IUPAC Name: (4S,5S)-4,6-dimethyl-5-phenylmethoxyheptanal Traditional Name: (4S,5S)-5-benzoxy-4,6-dimethyl-enanthaldehyde Formula: C16H24O2 MolecularWeight: 248.36056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O2/c1-13(2)16(14(3)8-7-11-17)18-12-15-9-5-4-6-10-15/h4-6,9-11,13-14,16H,7-8,12H2,1-3H3/t14-,16-/m0/s1