diethyl 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]propanedioate CAS Name: 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]propanedioate Traditional Name: 2-acetamido-2-[2-(4-methylsulfinylphenyl)ethyl]malonic acid diethyl ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=C(C=C1)S(=O)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCC1=CC=C(C=C1)S(=O)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H25NO6S/c1-5-24-16(21)18(19-13(3)20,17(22)25-6-2)12-11-14-7-9-15(10-8-14)26(4)23/h7-10H,5-6,11-12H2,1-4H3,(H,19,20)