2-(3-methyl-1-phenylsulfanyl-butyl)-3-oxidanyl-cyclopent-2-en-1-one

Systemtic Name: 2-(3-methyl-1-phenylsulfanyl-butyl)-3-oxidanyl-cyclopent-2-en-1-one Openeye Name: 3-hydroxy-2-(3-methyl-1-phenylsulfanyl-butyl)cyclopent-2-en-1-one CAS Name: 3-hydroxy-2-[3-methyl-1-(phenylthio)butyl]-1-cyclopent-2-enone IUPAC Name: 3-hydroxy-2-(3-methyl-1-phenylsulfanylbutyl)cyclopent-2-en-1-one Traditional Name: 3-hydroxy-2-[3-methyl-1-(phenylthio)butyl]cyclopent-2-en-1-one Formula: C16H20O2S MolecularWeight: 276.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=C(CCC1=O)O)SC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C1=C(CCC1=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C16H20O2S/c1-11(2)10-15(16-13(17)8-9-14(16)18)19-12-6-4-3-5-7-12/h3-7,11,15,17H,8-10H2,1-2H3