(E)-5-phenylsulfanyltridec-3-en-2-one

Systemtic Name: (E)-5-phenylsulfanyltridec-3-en-2-one Openeye Name: (E)-5-phenylsulfanyltridec-3-en-2-one CAS Name: (E)-5-(phenylthio)-3-tridecen-2-one IUPAC Name: (E)-5-phenylsulfanyltridec-3-en-2-one Traditional Name: (E)-5-(phenylthio)tridec-3-en-2-one Formula: C19H28OS MolecularWeight: 304.49002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28OS/c1-3-4-5-6-7-9-14-19(16-15-17(2)20)21-18-12-10-8-11-13-18/h8,10-13,15-16,19H,3-7,9,14H2,1-2H3/b16-15+