(E)-3-methyl-1-phenylsulfanyl-hept-1-en-4-one

Systemtic Name: (E)-3-methyl-1-phenylsulfanyl-hept-1-en-4-one Openeye Name: (E)-3-methyl-1-phenylsulfanyl-hept-1-en-4-one CAS Name: (E)-3-methyl-1-(phenylthio)-1-hepten-4-one IUPAC Name: (E)-3-methyl-1-phenylsulfanylhept-1-en-4-one Traditional Name: (E)-3-methyl-1-(phenylthio)hept-1-en-4-one Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C)C=CSC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C14H18OS/c1-3-7-14(15)12(2)10-11-16-13-8-5-4-6-9-13/h4-6,8-12H,3,7H2,1-2H3/b11-10+