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

Systemtic Name: diethyl 3-methyl-1-[(6-nitro-1,3-benzodioxol-5-yl)carbonyl]-5-oxidanyl-pyrrolidine-2,2-dicarboxylate Openeye Name: diethyl 5-hydroxy-3-methyl-1-(6-nitro-1,3-benzodioxole-5-carbonyl)pyrrolidine-2,2-dicarboxylate CAS Name: 5-hydroxy-3-methyl-1-[(6-nitro-1,3-benzodioxol-5-yl)-oxomethyl]pyrrolidine-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-hydroxy-3-methyl-1-(6-nitro-1,3-benzodioxole-5-carbonyl)pyrrolidine-2,2-dicarboxylate Traditional Name: 5-hydroxy-3-methyl-1-(6-nitropiperonyloyl)pyrrolidine-2,2-dicarboxylic acid diethyl ester Formula: C19H22N2O10 MolecularWeight: 438.38538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(N1C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C(CC(N1C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)O)C)C(=O)OCC

InChI

InChI=1S/C19H22N2O10/c1-4-28-17(24)19(18(25)29-5-2)10(3)6-15(22)20(19)16(23)11-7-13-14(31-9-30-13)8-12(11)21(26)27/h7-8,10,15,22H,4-6,9H2,1-3H3