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

Systemtic Name: ethanedioic acid; 1-[3-(4-phenylmethoxyphenoxy)propyl]pyrrolidine Openeye Name: 1-[3-(4-benzyloxyphenoxy)propyl]pyrrolidine; oxalic acid CAS Name: oxalic acid; 1-[3-(4-phenylmethoxyphenoxy)propyl]pyrrolidine IUPAC Name: oxalic acid; 1-[3-(4-phenylmethoxyphenoxy)propyl]pyrrolidine Traditional Name: 1-[3-(4-benzoxyphenoxy)propyl]pyrrolidine; oxalic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25NO2.C2H2O4/c1-2-7-18(8-3-1)17-23-20-11-9-19(10-12-20)22-16-6-15-21-13-4-5-14-21;3-1(4)2(5)6/h1-3,7-12H,4-6,13-17H2;(H,3,4)(H,5,6)