(phenylmethyl) (E,2S)-2-methyl-2-(3-oxidanylidenepropylsulfanyl)pent-3-enoate

Systemtic Name: (phenylmethyl) (E,2S)-2-methyl-2-(3-oxidanylidenepropylsulfanyl)pent-3-enoate Openeye Name: benzyl (E,2S)-2-methyl-2-(3-oxopropylsulfanyl)pent-3-enoate CAS Name: (E,2S)-2-methyl-2-(3-oxopropylthio)-3-pentenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E,2S)-2-methyl-2-(3-oxopropylsulfanyl)pent-3-enoate Traditional Name: (E,2S)-2-(3-ketopropylthio)-2-methyl-pent-3-enoic acid benzyl ester Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C)(C(=O)OCC1=CC=CC=C1)SCCC=O

Isomeric SMILES

C/C=C/[C@@](C)(C(=O)OCC1=CC=CC=C1)SCCC=O

InChI

InChI=1S/C16H20O3S/c1-3-10-16(2,20-12-7-11-17)15(18)19-13-14-8-5-4-6-9-14/h3-6,8-11H,7,12-13H2,1-2H3/b10-3+/t16-/m0/s1