1-[(2-bromophenyl)methyl]-4-butan-2-yl-piperazine; ethanedioic acid

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-butan-2-yl-piperazine; ethanedioic acid Openeye Name: 1-[(2-bromophenyl)methyl]-4-sec-butyl-piperazine; oxalic acid CAS Name: 1-[(2-bromophenyl)methyl]-4-butan-2-ylpiperazine; oxalic acid IUPAC Name: 1-[(2-bromophenyl)methyl]-4-butan-2-ylpiperazine; oxalic acid Traditional Name: 1-(2-bromobenzyl)-4-sec-butyl-piperazine; oxalic acid Formula: C17H25BrN2O4 MolecularWeight: 401.2954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)CC2=CC=CC=C2Br.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)N1CCN(CC1)CC2=CC=CC=C2Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23BrN2.C2H2O4/c1-3-13(2)18-10-8-17(9-11-18)12-14-6-4-5-7-15(14)16;3-1(4)2(5)6/h4-7,13H,3,8-12H2,1-2H3;(H,3,4)(H,5,6)