5-(2-chlorophenyl)-6-oxidanyl-4-(phenylmethylsulfanyl)oxan-3-one

Systemtic Name: 5-(2-chlorophenyl)-6-oxidanyl-4-(phenylmethylsulfanyl)oxan-3-one Openeye Name: 4-benzylsulfanyl-5-(2-chlorophenyl)-6-hydroxy-tetrahydropyran-3-one CAS Name: 5-(2-chlorophenyl)-6-hydroxy-4-(phenylmethylthio)-3-oxanone IUPAC Name: 4-benzylsulfanyl-5-(2-chlorophenyl)-6-hydroxyoxan-3-one Traditional Name: 4-(benzylthio)-5-(2-chlorophenyl)-6-hydroxy-tetrahydropyran-3-one Formula: C18H17ClO3S MolecularWeight: 348.84378

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(C(C(O1)O)C2=CC=CC=C2Cl)SCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)C(C(C(O1)O)C2=CC=CC=C2Cl)SCC3=CC=CC=C3

InChI

InChI=1S/C18H17ClO3S/c19-14-9-5-4-8-13(14)16-17(15(20)10-22-18(16)21)23-11-12-6-2-1-3-7-12/h1-9,16-18,21H,10-11H2