ethanedioic acid; N-[2-(4-phenylmethoxyphenoxy)ethyl]cyclopentanamine

Systemtic Name: ethanedioic acid; N-[2-(4-phenylmethoxyphenoxy)ethyl]cyclopentanamine Openeye Name: N-[2-(4-benzyloxyphenoxy)ethyl]cyclopentanamine; oxalic acid CAS Name: oxalic acid; N-[2-(4-phenylmethoxyphenoxy)ethyl]cyclopentanamine IUPAC Name: oxalic acid; N-[2-(4-phenylmethoxyphenoxy)ethyl]cyclopentanamine Traditional Name: 2-(4-benzoxyphenoxy)ethyl-cyclopentyl-amine; oxalic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCCOC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)NCCOC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

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