tert-butyl 3-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: tert-butyl 3-(4-methylphenyl)sulfanylpropanoate Openeye Name: tert-butyl 3-(p-tolylsulfanyl)propanoate CAS Name: 3-[(4-methylphenyl)thio]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-methylphenyl)sulfanylpropanoate Traditional Name: 3-(p-tolylthio)propionic acid tert-butyl ester Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)OC(C)(C)C

InChI

InChI=1S/C14H20O2S/c1-11-5-7-12(8-6-11)17-10-9-13(15)16-14(2,3)4/h5-8H,9-10H2,1-4H3