1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine; ethanedioic acid

Systemtic Name: 1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-4-methyl-piperazine; oxalic acid Formula: C16H22BrClN2O5 MolecularWeight: 437.71328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCN2CCN(CC2)C)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCN2CCN(CC2)C)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20BrClN2O.C2H2O4/c1-11-9-12(15)14(13(16)10-11)19-8-7-18-5-3-17(2)4-6-18;3-1(4)2(5)6/h9-10H,3-8H2,1-2H3;(H,3,4)(H,5,6)