(E)-3-phenylsulfanyltetradec-2-enal

Systemtic Name: (E)-3-phenylsulfanyltetradec-2-enal Openeye Name: (E)-3-phenylsulfanyltetradec-2-enal CAS Name: (E)-3-(phenylthio)-2-tetradecenal IUPAC Name: (E)-3-phenylsulfanyltetradec-2-enal Traditional Name: (E)-3-(phenylthio)tetradec-2-enal Formula: C20H30OS MolecularWeight: 318.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=CC=O)SC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C20H30OS/c1-2-3-4-5-6-7-8-9-11-16-20(17-18-21)22-19-14-12-10-13-15-19/h10,12-15,17-18H,2-9,11,16H2,1H3/b20-17+