(1S,5R,6S)-5-methyl-6-phenylsulfanyl-8-oxabicyclo[3.2.1]octan-3-one

Systemtic Name: (1S,5R,6S)-5-methyl-6-phenylsulfanyl-8-oxabicyclo[3.2.1]octan-3-one Openeye Name: (1S,5R,6S)-5-methyl-6-phenylsulfanyl-8-oxabicyclo[3.2.1]octan-3-one CAS Name: (1S,5R,6S)-5-methyl-6-(phenylthio)-8-oxabicyclo[3.2.1]octan-3-one IUPAC Name: (1S,5R,6S)-5-methyl-6-phenylsulfanyl-8-oxabicyclo[3.2.1]octan-3-one Traditional Name: (1S,5R,6S)-5-methyl-6-(phenylthio)-8-oxabicyclo[3.2.1]octan-3-one Formula: C14H16O2S MolecularWeight: 248.34064

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(=O)CC(O1)CC2SC3=CC=CC=C3

Isomeric SMILES

C[C@]12CC(=O)C[C@H](O1)C[C@@H]2SC3=CC=CC=C3

InChI

InChI=1S/C14H16O2S/c1-14-9-10(15)7-11(16-14)8-13(14)17-12-5-3-2-4-6-12/h2-6,11,13H,7-9H2,1H3/t11-,13-,14+/m0/s1