2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-butanoic acid

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-butanoic acid Openeye Name: 2-(2-tert-butoxy-2-oxo-ethyl)sulfanyl-4-phenyl-butanoic acid CAS Name: 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]-4-phenylbutanoic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanyl-4-phenylbutanoic acid Traditional Name: 2-[(2-tert-butoxy-2-keto-ethyl)thio]-4-phenyl-butyric acid Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC(CCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)CSC(CCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H22O4S/c1-16(2,3)20-14(17)11-21-13(15(18)19)10-9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,18,19)