diethyl 2-[(3-acetamido-4-nitro-phenyl)methyl-ethanoyl-amino]-2-methoxy-propanedioate

Systemtic Name: diethyl 2-[(3-acetamido-4-nitro-phenyl)methyl-ethanoyl-amino]-2-methoxy-propanedioate Openeye Name: diethyl 2-[(3-acetamido-4-nitro-phenyl)methyl-acetyl-amino]-2-methoxy-propanedioate CAS Name: 2-[(3-acetamido-4-nitrophenyl)methyl-acetylamino]-2-methoxypropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-acetamido-4-nitrophenyl)methyl-acetylamino]-2-methoxypropanedioate Traditional Name: 2-[(3-acetamido-4-nitro-benzyl)-acetyl-amino]-2-methoxy-malonic acid diethyl ester Formula: C19H25N3O9 MolecularWeight: 439.4165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O9/c1-6-30-17(25)19(29-5,18(26)31-7-2)21(13(4)24)11-14-8-9-16(22(27)28)15(10-14)20-12(3)23/h8-10H,6-7,11H2,1-5H3,(H,20,23)