ethanedioic acid; 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazine Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-benzoxybenzyl)-4-ethyl-piperazine; oxalic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O.C2H2O4/c1-2-21-11-13-22(14-12-21)16-19-9-6-10-20(15-19)23-17-18-7-4-3-5-8-18;3-1(4)2(5)6/h3-10,15H,2,11-14,16-17H2,1H3;(H,3,4)(H,5,6)