[(2S,4S)-4-oxidanyl-1-[(2R)-6-oxidanylidene-2,3-dihydropyran-2-yl]-8-phenyl-octan-2-yl] ethanoate

Systemtic Name: [(2S,4S)-4-oxidanyl-1-[(2R)-6-oxidanylidene-2,3-dihydropyran-2-yl]-8-phenyl-octan-2-yl] ethanoate Openeye Name: [(1S,3S)-3-hydroxy-1-[[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]-7-phenyl-heptyl] acetate CAS Name: acetic acid [(2S,4S)-4-hydroxy-1-[(2R)-6-oxo-2,3-dihydropyran-2-yl]-8-phenyloctan-2-yl] ester IUPAC Name: [(2S,4S)-4-hydroxy-1-[(2R)-6-oxo-2,3-dihydropyran-2-yl]-8-phenyloctan-2-yl] acetate Traditional Name: acetic acid [(1S,3S)-3-hydroxy-1-[[(2R)-6-keto-2,3-dihydropyran-2-yl]methyl]-7-phenyl-heptyl] ester Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1CC=CC(=O)O1)CC(CCCCC2=CC=CC=C2)O

Isomeric SMILES

CC(=O)O[C@H](C[C@H]1CC=CC(=O)O1)C[C@H](CCCCC2=CC=CC=C2)O

InChI

InChI=1S/C21H28O5/c1-16(22)25-20(15-19-12-7-13-21(24)26-19)14-18(23)11-6-5-10-17-8-3-2-4-9-17/h2-4,7-9,13,18-20,23H,5-6,10-12,14-15H2,1H3/t18-,19+,20-/m0/s1