1-[3-(3-bromanylphenoxy)propyl]-4-methyl-piperazine; ethanedioic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21BrN2O.C2H2O4/c1-16-7-9-17(10-8-16)6-3-11-18-14-5-2-4-13(15)12-14;3-1(4)2(5)6/h2,4-5,12H,3,6-11H2,1H3;(H,3,4)(H,5,6)