diethyl 2-[(5-nitro-2-propan-2-yloxycarbonyl-phenyl)amino]-2-propan-2-yloxy-propanedioate

Systemtic Name: diethyl 2-[(5-nitro-2-propan-2-yloxycarbonyl-phenyl)amino]-2-propan-2-yloxy-propanedioate Openeye Name: diethyl 2-isopropoxy-2-(2-isopropoxycarbonyl-5-nitro-anilino)propanedioate CAS Name: 2-[5-nitro-2-[oxo(propan-2-yloxy)methyl]anilino]-2-propan-2-yloxypropanedioic acid diethyl ester IUPAC Name: diethyl 2-(5-nitro-2-propan-2-yloxycarbonylanilino)-2-propan-2-yloxypropanedioate Traditional Name: 2-isopropoxy-2-(2-isopropoxycarbonyl-5-nitro-anilino)malonic acid diethyl ester Formula: C20H28N2O9 MolecularWeight: 440.44432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)(NC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C)OC(C)C

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)(NC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C)OC(C)C

InChI

InChI=1S/C20H28N2O9/c1-7-28-18(24)20(31-13(5)6,19(25)29-8-2)21-16-11-14(22(26)27)9-10-15(16)17(23)30-12(3)4/h9-13,21H,7-8H2,1-6H3