3-(4-tert-butylphenyl)sulfanyl-2-methyl-propanoic acid

Systemtic Name: 3-(4-tert-butylphenyl)sulfanyl-2-methyl-propanoic acid Openeye Name: 3-(4-tert-butylphenyl)sulfanyl-2-methyl-propanoic acid CAS Name: 3-[(4-tert-butylphenyl)thio]-2-methylpropanoic acid IUPAC Name: 3-(4-tert-butylphenyl)sulfanyl-2-methylpropanoic acid Traditional Name: 3-[(4-tert-butylphenyl)thio]-2-methyl-propionic acid Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=C(C=C1)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(CSC1=CC=C(C=C1)C(C)(C)C)C(=O)O

InChI

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