ethanedioic acid; 1-[2-(2-fluoranylphenoxy)ethyl]-4-(phenylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-[2-(2-fluoranylphenoxy)ethyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[2-(2-fluorophenoxy)ethyl]piperazine; oxalic acid CAS Name: 1-[2-(2-fluorophenoxy)ethyl]-4-(phenylmethyl)piperazine; oxalic acid IUPAC Name: 1-benzyl-4-[2-(2-fluorophenoxy)ethyl]piperazine; oxalic acid Traditional Name: 1-benzyl-4-[2-(2-fluorophenoxy)ethyl]piperazine; oxalic acid Formula: C21H25FN2O5 MolecularWeight: 404.432003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2F)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2F)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23FN2O.C2H2O4/c20-18-8-4-5-9-19(18)23-15-14-21-10-12-22(13-11-21)16-17-6-2-1-3-7-17;3-1(4)2(5)6/h1-9H,10-16H2;(H,3,4)(H,5,6)