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

Systemtic Name: diethyl 2-acetamido-2-[[4-[ethanoyl(methyl)amino]-3-nitro-phenyl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[4-[acetyl(methyl)amino]-3-nitro-phenyl]methyl]propanedioate CAS Name: 2-acetamido-2-[[4-[acetyl(methyl)amino]-3-nitrophenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[4-[acetyl(methyl)amino]-3-nitrophenyl]methyl]propanedioate Traditional Name: 2-acetamido-2-[4-[acetyl(methyl)amino]-3-nitro-benzyl]malonic acid diethyl ester Formula: C19H25N3O8 MolecularWeight: 423.4171

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O8/c1-6-29-17(25)19(20-12(3)23,18(26)30-7-2)11-14-8-9-15(21(5)13(4)24)16(10-14)22(27)28/h8-10H,6-7,11H2,1-5H3,(H,20,23)