(E,3S,5S)-5-methoxy-7-phenyl-3-phenylsulfanyl-hept-6-enal

Systemtic Name: (E,3S,5S)-5-methoxy-7-phenyl-3-phenylsulfanyl-hept-6-enal Openeye Name: (E,3S,5S)-5-methoxy-7-phenyl-3-phenylsulfanyl-hept-6-enal CAS Name: (E,3S,5S)-5-methoxy-7-phenyl-3-(phenylthio)-6-heptenal IUPAC Name: (E,3S,5S)-5-methoxy-7-phenyl-3-phenylsulfanylhept-6-enal Traditional Name: (E,3S,5S)-5-methoxy-7-phenyl-3-(phenylthio)hept-6-enal Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CC=O)SC1=CC=CC=C1)C=CC2=CC=CC=C2

Isomeric SMILES

CO[C@@H](C[C@@H](CC=O)SC1=CC=CC=C1)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H22O2S/c1-22-18(13-12-17-8-4-2-5-9-17)16-20(14-15-21)23-19-10-6-3-7-11-19/h2-13,15,18,20H,14,16H2,1H3/b13-12+/t18-,20-/m1/s1