5-phenylsulfanylbicyclo[3.3.1]nonan-3-one

Systemtic Name: 5-phenylsulfanylbicyclo[3.3.1]nonan-3-one Openeye Name: 5-phenylsulfanylbicyclo[3.3.1]nonan-3-one CAS Name: 5-(phenylthio)-3-bicyclo[3.3.1]nonanone IUPAC Name: 5-phenylsulfanylbicyclo[3.3.1]nonan-3-one Traditional Name: 5-(phenylthio)bicyclo[3.3.1]nonan-3-one Formula: C15H18OS MolecularWeight: 246.36782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18OS/c16-13-9-12-5-4-8-15(10-12,11-13)17-14-6-2-1-3-7-14/h1-3,6-7,12H,4-5,8-11H2