3-phenylsulfanyl-2,3,5,6,7,8,9,10-octahydro-1H-cyclopenta[9]annulen-4-one

Systemtic Name: 3-phenylsulfanyl-2,3,5,6,7,8,9,10-octahydro-1H-cyclopenta[9]annulen-4-one Openeye Name: 3-phenylsulfanyl-2,3,5,6,7,8,9,10-octahydro-1H-cyclopenta[9]annulen-4-one CAS Name: 3-(phenylthio)-2,3,5,6,7,8,9,10-octahydro-1H-cyclopenta[9]annulen-4-one IUPAC Name: 3-phenylsulfanyl-2,3,5,6,7,8,9,10-octahydro-1H-cyclopenta[9]annulen-4-one Traditional Name: 3-(phenylthio)-2,3,5,6,7,8,9,10-octahydro-1H-cyclopentacyclononen-4-one Formula: C18H22OS MolecularWeight: 286.43168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=O)C2=C(CC1)CCC2SC3=CC=CC=C3

Isomeric SMILES

C1CCCC(=O)C2=C(CC1)CCC2SC3=CC=CC=C3

InChI

InChI=1S/C18H22OS/c19-16-11-7-2-1-4-8-14-12-13-17(18(14)16)20-15-9-5-3-6-10-15/h3,5-6,9-10,17H,1-2,4,7-8,11-13H2