1-[(3-bromophenyl)methyl]-4-(phenylmethyl)piperidine; ethanedioic acid

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(phenylmethyl)piperidine; ethanedioic acid Openeye Name: 4-benzyl-1-[(3-bromophenyl)methyl]piperidine; oxalic acid CAS Name: 1-[(3-bromophenyl)methyl]-4-(phenylmethyl)piperidine; oxalic acid IUPAC Name: 4-benzyl-1-[(3-bromophenyl)methyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-(3-bromobenzyl)piperidine; oxalic acid Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22BrN.C2H2O4/c20-19-8-4-7-18(14-19)15-21-11-9-17(10-12-21)13-16-5-2-1-3-6-16;3-1(4)2(5)6/h1-8,14,17H,9-13,15H2;(H,3,4)(H,5,6)