1-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(3-bromo-4-ethoxy-5-methoxy-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(3-bromo-4-ethoxy-5-methoxyphenyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(3-bromo-4-ethoxy-5-methoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(3-bromo-4-ethoxy-5-methoxy-benzylidene)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C15H23BrN3O2+ MolecularWeight: 357.26602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=NN2CC[NH+](CC2)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=N\N2CC[NH+](CC2)C)OC

InChI

InChI=1S/C15H22BrN3O2/c1-4-21-15-13(16)9-12(10-14(15)20-3)11-17-19-7-5-18(2)6-8-19/h9-11H,4-8H2,1-3H3/p+1/b17-11-