2-fluoranyl-3,3,5,5-tetramethyl-2-phenylsulfanyl-cyclohexan-1-one

Systemtic Name: 2-fluoranyl-3,3,5,5-tetramethyl-2-phenylsulfanyl-cyclohexan-1-one Openeye Name: 2-fluoro-3,3,5,5-tetramethyl-2-phenylsulfanyl-cyclohexanone CAS Name: 2-fluoro-3,3,5,5-tetramethyl-2-(phenylthio)-1-cyclohexanone IUPAC Name: 2-fluoro-3,3,5,5-tetramethyl-2-phenylsulfanylcyclohexan-1-one Traditional Name: 2-fluoro-3,3,5,5-tetramethyl-2-(phenylthio)cyclohexanone Formula: C16H21FOS MolecularWeight: 280.400743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21FOS/c1-14(2)10-13(18)16(17,15(3,4)11-14)19-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3