(2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid (2-isopropoxy-2-keto-ethyl) ester Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C(CCSC)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)OC(=O)COC(=O)C(CCSC)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H23NO5S/c1-12(2)23-15(19)11-22-17(21)14(9-10-24-3)18-16(20)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H,18,20)