(E)-6-methyl-5-phenylsulfanyl-hept-3-en-2-one

Systemtic Name: (E)-6-methyl-5-phenylsulfanyl-hept-3-en-2-one Openeye Name: (E)-6-methyl-5-phenylsulfanyl-hept-3-en-2-one CAS Name: (E)-6-methyl-5-(phenylthio)-3-hepten-2-one IUPAC Name: (E)-6-methyl-5-phenylsulfanylhept-3-en-2-one Traditional Name: (E)-6-methyl-5-(phenylthio)hept-3-en-2-one Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=CC(=O)C)SC1=CC=CC=C1

Isomeric SMILES

CC(C)C(/C=C/C(=O)C)SC1=CC=CC=C1

InChI

InChI=1S/C14H18OS/c1-11(2)14(10-9-12(3)15)16-13-7-5-4-6-8-13/h4-11,14H,1-3H3/b10-9+