4,4,6,6-tetramethyl-2-phenylsulfanyl-cyclohex-2-en-1-one

Systemtic Name: 4,4,6,6-tetramethyl-2-phenylsulfanyl-cyclohex-2-en-1-one Openeye Name: 4,4,6,6-tetramethyl-2-phenylsulfanyl-cyclohex-2-en-1-one CAS Name: 4,4,6,6-tetramethyl-2-(phenylthio)-1-cyclohex-2-enone IUPAC Name: 4,4,6,6-tetramethyl-2-phenylsulfanylcyclohex-2-en-1-one Traditional Name: 4,4,6,6-tetramethyl-2-(phenylthio)cyclohex-2-en-1-one Formula: C16H20OS MolecularWeight: 260.3944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)C(=C1)SC2=CC=CC=C2)(C)C)C

Isomeric SMILES

CC1(CC(C(=O)C(=C1)SC2=CC=CC=C2)(C)C)C

InChI

InChI=1S/C16H20OS/c1-15(2)10-13(14(17)16(3,4)11-15)18-12-8-6-5-7-9-12/h5-10H,11H2,1-4H3