1-[3-ethoxy-4-[2-(4-fluoranylphenoxy)ethoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[3-ethoxy-4-[2-(4-fluoranylphenoxy)ethoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[3-ethoxy-4-[2-(4-fluorophenoxy)ethoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[3-ethoxy-4-[2-(4-fluorophenoxy)ethoxy]phenyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[3-ethoxy-4-[2-(4-fluorophenoxy)ethoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[3-ethoxy-4-[2-(4-fluorophenoxy)ethoxy]benzylidene]-(4-methylpiperazin-4-ium-1-yl)amine Formula: C22H29FN3O3+ MolecularWeight: 402.482363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2CC[NH+](CC2)C)OCCOC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2CC[NH+](CC2)C)OCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN3O3/c1-3-27-22-16-18(17-24-26-12-10-25(2)11-13-26)4-9-21(22)29-15-14-28-20-7-5-19(23)6-8-20/h4-9,16-17H,3,10-15H2,1-2H3/p+1/b24-17-