3-phenylsulfanylcyclodecan-1-one

Systemtic Name: 3-phenylsulfanylcyclodecan-1-one Openeye Name: 3-phenylsulfanylcyclodecanone CAS Name: 3-(phenylthio)-1-cyclodecanone IUPAC Name: 3-phenylsulfanylcyclodecan-1-one Traditional Name: 3-(phenylthio)cyclodecanone Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC(=O)CCC1)SC2=CC=CC=C2

Isomeric SMILES

C1CCCC(CC(=O)CCC1)SC2=CC=CC=C2

InChI

InChI=1S/C16H22OS/c17-14-9-5-2-1-3-6-12-16(13-14)18-15-10-7-4-8-11-15/h4,7-8,10-11,16H,1-3,5-6,9,12-13H2