diethyl 2-[(2-nitrophenyl)methyl]propanedioate; ethanamide

Systemtic Name: diethyl 2-[(2-nitrophenyl)methyl]propanedioate; ethanamide Openeye Name: acetamide; diethyl 2-[(2-nitrophenyl)methyl]propanedioate CAS Name: acetamide; 2-[(2-nitrophenyl)methyl]propanedioic acid diethyl ester IUPAC Name: acetamide; diethyl 2-[(2-nitrophenyl)methyl]propanedioate Traditional Name: acetamide; 2-(2-nitrobenzyl)malonic acid diethyl ester Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1[N+](=O)[O-])C(=O)OCC.CC(=O)N

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1[N+](=O)[O-])C(=O)OCC.CC(=O)N

InChI

InChI=1S/C14H17NO6.C2H5NO/c1-3-20-13(16)11(14(17)21-4-2)9-10-7-5-6-8-12(10)15(18)19;1-2(3)4/h5-8,11H,3-4,9H2,1-2H3;1H3,(H2,3,4)