diethyl 5-ethoxy-1-[(6-nitro-1,3-benzodioxol-5-yl)carbonyl]pyrrolidine-2,2-dicarboxylate

Systemtic Name: diethyl 5-ethoxy-1-[(6-nitro-1,3-benzodioxol-5-yl)carbonyl]pyrrolidine-2,2-dicarboxylate Openeye Name: diethyl 5-ethoxy-1-(6-nitro-1,3-benzodioxole-5-carbonyl)pyrrolidine-2,2-dicarboxylate CAS Name: 5-ethoxy-1-[(6-nitro-1,3-benzodioxol-5-yl)-oxomethyl]pyrrolidine-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-ethoxy-1-(6-nitro-1,3-benzodioxole-5-carbonyl)pyrrolidine-2,2-dicarboxylate Traditional Name: 5-ethoxy-1-(6-nitropiperonyloyl)pyrrolidine-2,2-dicarboxylic acid diethyl ester Formula: C20H24N2O10 MolecularWeight: 452.41196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCC(N1C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC1CCC(N1C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H24N2O10/c1-4-28-16-7-8-20(18(24)29-5-2,19(25)30-6-3)21(16)17(23)12-9-14-15(32-11-31-14)10-13(12)22(26)27/h9-10,16H,4-8,11H2,1-3H3