[(3S,5S)-3,5-dimethyl-6-(phenylcarbonyloxy)hexyl] benzoate

Systemtic Name: [(3S,5S)-3,5-dimethyl-6-(phenylcarbonyloxy)hexyl] benzoate Openeye Name: [(3S,5S)-6-benzoyloxy-3,5-dimethyl-hexyl] benzoate CAS Name: benzoic acid [(3S,5S)-6-benzoyloxy-3,5-dimethylhexyl] ester IUPAC Name: [(3S,5S)-6-benzoyloxy-3,5-dimethylhexyl] benzoate Traditional Name: benzoic acid [(3S,5S)-6-benzoyloxy-3,5-dimethyl-hexyl] ester Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1=CC=CC=C1)CC(C)COC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CCOC(=O)C1=CC=CC=C1)C[C@H](C)COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26O4/c1-17(13-14-25-21(23)19-9-5-3-6-10-19)15-18(2)16-26-22(24)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3/t17-,18+/m1/s1