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

Systemtic Name: diethyl 2-acetamido-2-[(2-ethoxy-5-nitro-phenyl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(2-ethoxy-5-nitro-phenyl)methyl]propanedioate CAS Name: 2-acetamido-2-[(2-ethoxy-5-nitrophenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(2-ethoxy-5-nitrophenyl)methyl]propanedioate Traditional Name: 2-acetamido-2-(2-ethoxy-5-nitro-benzyl)malonic acid diethyl ester Formula: C18H24N2O8 MolecularWeight: 396.39176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N+](=O)[O-])CC(C(=O)OCC)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N+](=O)[O-])CC(C(=O)OCC)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H24N2O8/c1-5-26-15-9-8-14(20(24)25)10-13(15)11-18(19-12(4)21,16(22)27-6-2)17(23)28-7-3/h8-10H,5-7,11H2,1-4H3,(H,19,21)