diethyl 2-acetamido-2-[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioate CAS Name: 2-acetamido-2-[[4-(2,2-dimethyl-1-oxopropyl)phenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioate Traditional Name: 2-acetamido-2-(4-pivaloylbenzyl)malonic acid diethyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)C(C)(C)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)C(C)(C)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C21H29NO6/c1-7-27-18(25)21(22-14(3)23,19(26)28-8-2)13-15-9-11-16(12-10-15)17(24)20(4,5)6/h9-12H,7-8,13H2,1-6H3,(H,22,23)