1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethyl]piperidine; ethanedioic acid

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethyl]piperidine; ethanedioic acid Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]piperidine; oxalic acid CAS Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]piperidine; oxalic acid IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]piperidine; oxalic acid Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]piperidine; oxalic acid Formula: C15H19BrClNO5 MolecularWeight: 408.67206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=C(C=C(C=C2)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCOC2=C(C=C(C=C2)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H17BrClNO.C2H2O4/c14-11-4-5-13(12(15)10-11)17-9-8-16-6-2-1-3-7-16;3-1(4)2(5)6/h4-5,10H,1-3,6-9H2;(H,3,4)(H,5,6)