diethyl 2-acetamido-2-[3-(4-nitrophenyl)propyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[3-(4-nitrophenyl)propyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[3-(4-nitrophenyl)propyl]propanedioate CAS Name: 2-acetamido-2-[3-(4-nitrophenyl)propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[3-(4-nitrophenyl)propyl]propanedioate Traditional Name: 2-acetamido-2-[3-(4-nitrophenyl)propyl]malonic acid diethyl ester Formula: C18H24N2O7 MolecularWeight: 380.39236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCCC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H24N2O7/c1-4-26-16(22)18(19-13(3)21,17(23)27-5-2)12-6-7-14-8-10-15(11-9-14)20(24)25/h8-11H,4-7,12H2,1-3H3,(H,19,21)