1-[(2-bromophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine; ethanedioic acid

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine; ethanedioic acid Openeye Name: 1-[(2-bromophenyl)methyl]-4-(3-pyridylmethyl)piperazine; oxalic acid CAS Name: 1-[(2-bromophenyl)methyl]-4-(3-pyridinylmethyl)piperazine; oxalic acid IUPAC Name: 1-[(2-bromophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine; oxalic acid Traditional Name: 1-(2-bromobenzyl)-4-(3-pyridylmethyl)piperazine; oxalic acid Formula: C19H22BrN3O4 MolecularWeight: 436.29968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)CC3=CC=CC=C3Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)CC3=CC=CC=C3Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H20BrN3.C2H2O4/c18-17-6-2-1-5-16(17)14-21-10-8-20(9-11-21)13-15-4-3-7-19-12-15;3-1(4)2(5)6/h1-7,12H,8-11,13-14H2;(H,3,4)(H,5,6)