[(Z)-4-acetyloxy-2-oxidanylidene-3-phenylsulfanyl-but-3-enyl] 2,2-dimethylpropanoate

Systemtic Name: [(Z)-4-acetyloxy-2-oxidanylidene-3-phenylsulfanyl-but-3-enyl] 2,2-dimethylpropanoate Openeye Name: [(Z)-4-acetoxy-2-oxo-3-phenylsulfanyl-but-3-enyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(Z)-4-acetyloxy-2-oxo-3-(phenylthio)but-3-enyl] ester IUPAC Name: [(Z)-4-acetyloxy-2-oxo-3-phenylsulfanylbut-3-enyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(Z)-4-acetoxy-2-keto-3-(phenylthio)but-3-enyl] ester Formula: C17H20O5S MolecularWeight: 336.4027

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC=C(C(=O)COC(=O)C(C)(C)C)SC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C17H20O5S/c1-12(18)21-11-15(23-13-8-6-5-7-9-13)14(19)10-22-16(20)17(2,3)4/h5-9,11H,10H2,1-4H3/b15-11-