3,7-bis(phenylsulfanyl)cyclooctan-1-one

Systemtic Name: 3,7-bis(phenylsulfanyl)cyclooctan-1-one Openeye Name: 3,7-bis(phenylsulfanyl)cyclooctanone CAS Name: 3,7-bis(phenylthio)-1-cyclooctanone IUPAC Name: 3,7-bis(phenylsulfanyl)cyclooctan-1-one Traditional Name: 3,7-bis(phenylthio)cyclooctanone Formula: C20H22OS2 MolecularWeight: 342.51808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(=O)CC(C1)SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1CC(CC(=O)CC(C1)SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H22OS2/c21-16-14-19(22-17-8-3-1-4-9-17)12-7-13-20(15-16)23-18-10-5-2-6-11-18/h1-6,8-11,19-20H,7,12-15H2