ethanedioic acid; 1-[3-(4-nitrophenoxy)propyl]pyrrolidine

Systemtic Name: ethanedioic acid; 1-[3-(4-nitrophenoxy)propyl]pyrrolidine Openeye Name: 1-[3-(4-nitrophenoxy)propyl]pyrrolidine; oxalic acid CAS Name: 1-[3-(4-nitrophenoxy)propyl]pyrrolidine; oxalic acid IUPAC Name: 1-[3-(4-nitrophenoxy)propyl]pyrrolidine; oxalic acid Traditional Name: 1-[3-(4-nitrophenoxy)propyl]pyrrolidine; oxalic acid Formula: C15H20N2O7 MolecularWeight: 340.3285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)CCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C13H18N2O3.C2H2O4/c16-15(17)12-4-6-13(7-5-12)18-11-3-10-14-8-1-2-9-14;3-1(4)2(5)6/h4-7H,1-3,8-11H2;(H,3,4)(H,5,6)