1-(5-bromanyl-2-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(5-bromanyl-2-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(5-bromo-2-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(5-bromo-2-methoxyphenyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(5-bromo-2-methoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(5-bromo-2-methoxy-benzylidene)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C13H19BrN3O+ MolecularWeight: 313.21346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C13H18BrN3O/c1-16-5-7-17(8-6-16)15-10-11-9-12(14)3-4-13(11)18-2/h3-4,9-10H,5-8H2,1-2H3/p+1/b15-10-