2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-3-phenylmethoxy-propanoic acid

Systemtic Name: 2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-3-phenylmethoxy-propanoic acid Openeye Name: 2-(3-acetylsulfanyl-2-methyl-propanoyl)oxy-3-benzyloxy-propanoic acid CAS Name: 2-[3-(acetylthio)-2-methyl-1-oxopropoxy]-3-phenylmethoxypropanoic acid IUPAC Name: 2-(3-acetylsulfanyl-2-methylpropanoyl)oxy-3-phenylmethoxypropanoic acid Traditional Name: 2-[3-(acetylthio)-2-methyl-propanoyl]oxy-3-benzoxy-propionic acid Formula: C16H20O6S MolecularWeight: 340.3914

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)OC(COCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)OC(COCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H20O6S/c1-11(10-23-12(2)17)16(20)22-14(15(18)19)9-21-8-13-6-4-3-5-7-13/h3-7,11,14H,8-10H2,1-2H3,(H,18,19)