1-[2-(4-chloranylphenoxy)ethyl]-4-(phenylmethyl)piperidine; ethanedioic acid

Systemtic Name: 1-[2-(4-chloranylphenoxy)ethyl]-4-(phenylmethyl)piperidine; ethanedioic acid Openeye Name: 4-benzyl-1-[2-(4-chlorophenoxy)ethyl]piperidine; oxalic acid CAS Name: 1-[2-(4-chlorophenoxy)ethyl]-4-(phenylmethyl)piperidine; oxalic acid IUPAC Name: 4-benzyl-1-[2-(4-chlorophenoxy)ethyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-[2-(4-chlorophenoxy)ethyl]piperidine; oxalic acid Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCOC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCOC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H24ClNO.C2H2O4/c21-19-6-8-20(9-7-19)23-15-14-22-12-10-18(11-13-22)16-17-4-2-1-3-5-17;3-1(4)2(5)6/h1-9,18H,10-16H2;(H,3,4)(H,5,6)