(4-methoxyphenyl) 2-acetamido-3-methyl-3-sulfanyl-butanoate

Systemtic Name: (4-methoxyphenyl) 2-acetamido-3-methyl-3-sulfanyl-butanoate Openeye Name: (4-methoxyphenyl) 2-acetamido-3-methyl-3-sulfanyl-butanoate CAS Name: 2-acetamido-3-mercapto-3-methylbutanoic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 2-acetamido-3-methyl-3-sulfanylbutanoate Traditional Name: 2-acetamido-3-mercapto-3-methyl-butyric acid (4-methoxyphenyl) ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)OC1=CC=C(C=C1)OC)C(C)(C)S

Isomeric SMILES

CC(=O)NC(C(=O)OC1=CC=C(C=C1)OC)C(C)(C)S

InChI

InChI=1S/C14H19NO4S/c1-9(16)15-12(14(2,3)20)13(17)19-11-7-5-10(18-4)6-8-11/h5-8,12,20H,1-4H3,(H,15,16)