N'-[(3-bromophenyl)methyl]-N'-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]propane-1,3-diamine

Systemtic Name: N'-[(3-bromophenyl)methyl]-N'-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]propane-1,3-diamine Openeye Name: N'-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N'-[(3-bromophenyl)methyl]propane-1,3-diamine CAS Name: N'-[(3-bromophenyl)methyl]-N'-[(3-methoxy-4-phenylmethoxyphenyl)methyl]propane-1,3-diamine IUPAC Name: N'-[(3-bromophenyl)methyl]-N'-[(3-methoxy-4-phenylmethoxyphenyl)methyl]propane-1,3-diamine Traditional Name: 3-aminopropyl-(4-benzoxy-3-methoxy-benzyl)-(3-bromobenzyl)amine Formula: C25H29BrN2O2 MolecularWeight: 469.41396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CCCN)CC2=CC(=CC=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CCCN)CC2=CC(=CC=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C25H29BrN2O2/c1-29-25-16-22(11-12-24(25)30-19-20-7-3-2-4-8-20)18-28(14-6-13-27)17-21-9-5-10-23(26)15-21/h2-5,7-12,15-16H,6,13-14,17-19,27H2,1H3