tert-butyl 2-(4-acetyloxyphenyl)sulfanyl-2-chloranyl-ethanoate

Systemtic Name: tert-butyl 2-(4-acetyloxyphenyl)sulfanyl-2-chloranyl-ethanoate Openeye Name: tert-butyl 2-(4-acetoxyphenyl)sulfanyl-2-chloro-acetate CAS Name: 2-[(4-acetyloxyphenyl)thio]-2-chloroacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-acetyloxyphenyl)sulfanyl-2-chloroacetate Traditional Name: 2-[(4-acetoxyphenyl)thio]-2-chloro-acetic acid tert-butyl ester Formula: C14H17ClO4S MolecularWeight: 316.80038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)SC(C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)SC(C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C14H17ClO4S/c1-9(16)18-10-5-7-11(8-6-10)20-12(15)13(17)19-14(2,3)4/h5-8,12H,1-4H3