3-ethanoyl-3-[(E)-4-phenylsulfanylbut-3-enyl]oxolan-2-one

Systemtic Name: 3-ethanoyl-3-[(E)-4-phenylsulfanylbut-3-enyl]oxolan-2-one Openeye Name: 3-acetyl-3-[(E)-4-phenylsulfanylbut-3-enyl]tetrahydrofuran-2-one CAS Name: 3-acetyl-3-[(E)-4-(phenylthio)but-3-enyl]-2-oxolanone IUPAC Name: 3-acetyl-3-[(E)-4-phenylsulfanylbut-3-enyl]oxolan-2-one Traditional Name: 3-acetyl-3-[(E)-4-(phenylthio)but-3-enyl]tetrahydrofuran-2-one Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCOC1=O)CCC=CSC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1(CCOC1=O)CC/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C16H18O3S/c1-13(17)16(10-11-19-15(16)18)9-5-6-12-20-14-7-3-2-4-8-14/h2-4,6-8,12H,5,9-11H2,1H3/b12-6+