[4-[[(3-bromophenyl)methyl-(pyridin-4-ylmethyl)amino]methyl]phenyl]methanamine

Systemtic Name: [4-[[(3-bromophenyl)methyl-(pyridin-4-ylmethyl)amino]methyl]phenyl]methanamine Openeye Name: [4-[[(3-bromophenyl)methyl-(4-pyridylmethyl)amino]methyl]phenyl]methanamine CAS Name: [4-[[(3-bromophenyl)methyl-(pyridin-4-ylmethyl)amino]methyl]phenyl]methanamine IUPAC Name: [4-[[(3-bromophenyl)methyl-(pyridin-4-ylmethyl)amino]methyl]phenyl]methanamine Traditional Name: [4-(aminomethyl)benzyl]-(3-bromobenzyl)-(4-pyridylmethyl)amine Formula: C21H22BrN3 MolecularWeight: 396.32348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN(CC2=CC=C(C=C2)CN)CC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN(CC2=CC=C(C=C2)CN)CC3=CC=NC=C3

InChI

InChI=1S/C21H22BrN3/c22-21-3-1-2-20(12-21)16-25(15-19-8-10-24-11-9-19)14-18-6-4-17(13-23)5-7-18/h1-12H,13-16,23H2