2-[(4-tert-butylphenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(4-tert-butylphenyl)methylthio]propanoic acid IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(4-tert-butylbenzyl)thio]propionic acid Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CC(C(=O)O)SCC1=CC=C(C=C1)C(C)(C)C

InChI

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