methyl (E,5S,6R)-5-methyl-6-phenyl-6-phenylsulfanyl-hex-3-enoate

Systemtic Name: methyl (E,5S,6R)-5-methyl-6-phenyl-6-phenylsulfanyl-hex-3-enoate Openeye Name: methyl (E,5S,6R)-5-methyl-6-phenyl-6-phenylsulfanyl-hex-3-enoate CAS Name: (E,5S,6R)-5-methyl-6-phenyl-6-(phenylthio)-3-hexenoic acid methyl ester IUPAC Name: methyl (E,5S,6R)-5-methyl-6-phenyl-6-phenylsulfanylhex-3-enoate Traditional Name: (E,5S,6R)-5-methyl-6-phenyl-6-(phenylthio)hex-3-enoic acid methyl ester Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CCC(=O)OC)C(C1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

C[C@@H](/C=C/CC(=O)OC)[C@H](C1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C20H22O2S/c1-16(10-9-15-19(21)22-2)20(17-11-5-3-6-12-17)23-18-13-7-4-8-14-18/h3-14,16,20H,15H2,1-2H3/b10-9+/t16-,20+/m0/s1