dimethyl 4-(3-nitrophenyl)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-nitrophenyl)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-nitrophenyl)-1-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-nitrophenyl)-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-nitrophenyl)-1-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-[3-(2-ketopyrrolidino)propyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CCCN3CCCC3=O

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CCCN3CCCC3=O

InChI

InChI=1S/C22H25N3O7/c1-31-21(27)17-13-23(9-5-11-24-10-4-8-19(24)26)14-18(22(28)32-2)20(17)15-6-3-7-16(12-15)25(29)30/h3,6-7,12-14,20H,4-5,8-11H2,1-2H3