(E)-1-phenylsulfanylhept-5-en-3-one

Systemtic Name: (E)-1-phenylsulfanylhept-5-en-3-one Openeye Name: (E)-1-phenylsulfanylhept-5-en-3-one CAS Name: (E)-1-(phenylthio)-5-hepten-3-one IUPAC Name: (E)-1-phenylsulfanylhept-5-en-3-one Traditional Name: (E)-1-(phenylthio)hept-5-en-3-one Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

C/C=C/CC(=O)CCSC1=CC=CC=C1

InChI

InChI=1S/C13H16OS/c1-2-3-7-12(14)10-11-15-13-8-5-4-6-9-13/h2-6,8-9H,7,10-11H2,1H3/b3-2+