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

Systemtic Name: N'-[(4-bromophenyl)methyl]-N'-[(4-methoxy-3-nitro-phenyl)methyl]propane-1,3-diamine Openeye Name: N'-[(4-bromophenyl)methyl]-N'-[(4-methoxy-3-nitro-phenyl)methyl]propane-1,3-diamine CAS Name: N'-[(4-bromophenyl)methyl]-N'-[(4-methoxy-3-nitrophenyl)methyl]propane-1,3-diamine IUPAC Name: N'-[(4-bromophenyl)methyl]-N'-[(4-methoxy-3-nitrophenyl)methyl]propane-1,3-diamine Traditional Name: 3-aminopropyl-(4-bromobenzyl)-(4-methoxy-3-nitro-benzyl)amine Formula: C18H22BrN3O3 MolecularWeight: 408.28958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCCN)CC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCCN)CC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H22BrN3O3/c1-25-18-8-5-15(11-17(18)22(23)24)13-21(10-2-9-20)12-14-3-6-16(19)7-4-14/h3-8,11H,2,9-10,12-13,20H2,1H3