(1S,6S)-6-phenylsulfanylbicyclo[4.3.1]decane-3,10-dione

Systemtic Name: (1S,6S)-6-phenylsulfanylbicyclo[4.3.1]decane-3,10-dione Openeye Name: (1S,6S)-6-phenylsulfanylbicyclo[4.3.1]decane-3,10-dione CAS Name: (1S,6S)-6-(phenylthio)bicyclo[4.3.1]decane-3,10-dione IUPAC Name: (1S,6S)-6-phenylsulfanylbicyclo[4.3.1]decane-3,10-dione Traditional Name: (1S,6S)-6-(phenylthio)bicyclo[4.3.1]decane-3,10-quinone Formula: C16H18O2S MolecularWeight: 274.37792

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(=O)CCC(C1)(C2=O)SC3=CC=CC=C3

Isomeric SMILES

C1C[C@H]2CC(=O)CC[C@@](C1)(C2=O)SC3=CC=CC=C3

InChI

InChI=1S/C16H18O2S/c17-13-8-10-16(19-14-6-2-1-3-7-14)9-4-5-12(11-13)15(16)18/h1-3,6-7,12H,4-5,8-11H2/t12-,16-/m0/s1