tert-butyl 4-oxidanylidene-3-phenylsulfanyl-pentanoate

Systemtic Name: tert-butyl 4-oxidanylidene-3-phenylsulfanyl-pentanoate Openeye Name: tert-butyl 4-oxo-3-phenylsulfanyl-pentanoate CAS Name: 4-oxo-3-(phenylthio)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-oxo-3-phenylsulfanylpentanoate Traditional Name: 4-keto-3-(phenylthio)valeric acid tert-butyl ester Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3S/c1-11(16)13(10-14(17)18-15(2,3)4)19-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3