4-[(E)-1-phenylsulfanyloct-2-enyl]oxolan-2-one

Systemtic Name: 4-[(E)-1-phenylsulfanyloct-2-enyl]oxolan-2-one Openeye Name: 4-[(E)-1-phenylsulfanyloct-2-enyl]tetrahydrofuran-2-one CAS Name: 4-[(E)-1-(phenylthio)oct-2-enyl]-2-oxolanone IUPAC Name: 4-[(E)-1-phenylsulfanyloct-2-enyl]oxolan-2-one Traditional Name: 4-[(E)-1-(phenylthio)oct-2-enyl]tetrahydrofuran-2-one Formula: C18H24O2S MolecularWeight: 304.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C1CC(=O)OC1)SC2=CC=CC=C2

Isomeric SMILES

CCCCC/C=C/C(C1CC(=O)OC1)SC2=CC=CC=C2

InChI

InChI=1S/C18H24O2S/c1-2-3-4-5-9-12-17(15-13-18(19)20-14-15)21-16-10-7-6-8-11-16/h6-12,15,17H,2-5,13-14H2,1H3/b12-9+