(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)OC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)OC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO5S/c1-26-21(25)18(15-9-5-3-6-10-15)27-20(24)17(13-14-28-2)22-19(23)16-11-7-4-8-12-16/h3-12,17-18H,13-14H2,1-2H3,(H,22,23)