(4-oxidanyl-2-oxidanylidene-3-phenylsulfanyl-but-3-enyl) 2,2-dimethylpropanoate

Systemtic Name: (4-oxidanyl-2-oxidanylidene-3-phenylsulfanyl-but-3-enyl) 2,2-dimethylpropanoate Openeye Name: (4-hydroxy-2-oxo-3-phenylsulfanyl-but-3-enyl) 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-hydroxy-2-oxo-3-(phenylthio)but-3-enyl] ester IUPAC Name: (4-hydroxy-2-oxo-3-phenylsulfanylbut-3-enyl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-hydroxy-2-keto-3-(phenylthio)but-3-enyl] ester Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC(=O)C(=CO)SC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)OCC(=O)C(=CO)SC1=CC=CC=C1

InChI

InChI=1S/C15H18O4S/c1-15(2,3)14(18)19-10-12(17)13(9-16)20-11-7-5-4-6-8-11/h4-9,16H,10H2,1-3H3