diethyl 2-acetamido-2-[[2-(2-diethoxyphosphorylethyl)-5-methyl-phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[2-(2-diethoxyphosphorylethyl)-5-methyl-phenyl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[2-(2-diethoxyphosphorylethyl)-5-methyl-phenyl]methyl]propanedioate CAS Name: 2-acetamido-2-[[2-(2-diethoxyphosphorylethyl)-5-methylphenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[2-(2-diethoxyphosphorylethyl)-5-methylphenyl]methyl]propanedioate Traditional Name: 2-acetamido-2-[2-(2-diethoxyphosphorylethyl)-5-methyl-benzyl]malonic acid diethyl ester Formula: C23H36NO8P MolecularWeight: 485.507601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36NO8P/c1-7-29-21(26)23(24-18(6)25,22(27)30-8-2)16-20-15-17(5)11-12-19(20)13-14-33(28,31-9-3)32-10-4/h11-12,15H,7-10,13-14,16H2,1-6H3,(H,24,25)