5-oxidanyl-7a-(phenylmethylsulfanyl)-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one

Systemtic Name: 5-oxidanyl-7a-(phenylmethylsulfanyl)-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one Openeye Name: 7a-benzylsulfanyl-5-hydroxy-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one CAS Name: 5-hydroxy-7a-(phenylmethylthio)-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one IUPAC Name: 7a-benzylsulfanyl-5-hydroxy-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one Traditional Name: 7a-(benzylthio)-5-hydroxy-3,4,4a,5,6,7-hexahydrocyclopenta[c]pyran-1-one Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C(C1O)CCOC2=O)SCC3=CC=CC=C3

Isomeric SMILES

C1CC2(C(C1O)CCOC2=O)SCC3=CC=CC=C3

InChI

InChI=1S/C15H18O3S/c16-13-6-8-15(12(13)7-9-18-14(15)17)19-10-11-4-2-1-3-5-11/h1-5,12-13,16H,6-10H2