1-[2-(3-bromanylphenoxy)ethyl]-4-ethyl-piperazine; ethanedioic acid

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethyl]-4-ethyl-piperazine; ethanedioic acid Openeye Name: 1-[2-(3-bromophenoxy)ethyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-[2-(3-bromophenoxy)ethyl]-4-ethylpiperazine; oxalic acid IUPAC Name: 1-[2-(3-bromophenoxy)ethyl]-4-ethylpiperazine; oxalic acid Traditional Name: 1-[2-(3-bromophenoxy)ethyl]-4-ethyl-piperazine; oxalic acid Formula: C16H23BrN2O5 MolecularWeight: 403.26822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21BrN2O.C2H2O4/c1-2-16-6-8-17(9-7-16)10-11-18-14-5-3-4-13(15)12-14;3-1(4)2(5)6/h3-5,12H,2,6-11H2,1H3;(H,3,4)(H,5,6)