1-[3,5-bis(bromanyl)-2-ethoxy-phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[3,5-bis(bromanyl)-2-ethoxy-phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(3,5-dibromo-2-ethoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(3,5-dibromo-2-ethoxyphenyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(3,5-dibromo-2-ethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(3,5-dibromo-2-ethoxy-benzylidene)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C14H20Br2N3O+ MolecularWeight: 406.1361

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C=NN2CC[NH+](CC2)C)Br)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1/C=N\N2CC[NH+](CC2)C)Br)Br

InChI

InChI=1S/C14H19Br2N3O/c1-3-20-14-11(8-12(15)9-13(14)16)10-17-19-6-4-18(2)5-7-19/h8-10H,3-7H2,1-2H3/p+1/b17-10-