diethyl 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methyl-propanedioate

Systemtic Name: diethyl 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methyl-propanedioate Openeye Name: diethyl 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methyl-propanedioate CAS Name: 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methylpropanedioate Traditional Name: 2-[3-acetamido-2-(2-nitrophenyl)propyl]-2-methyl-malonic acid diethyl ester Formula: C19H26N2O7 MolecularWeight: 394.41894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC(CNC(=O)C)C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)(CC(CNC(=O)C)C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C19H26N2O7/c1-5-27-17(23)19(4,18(24)28-6-2)11-14(12-20-13(3)22)15-9-7-8-10-16(15)21(25)26/h7-10,14H,5-6,11-12H2,1-4H3,(H,20,22)