1-[4-(4-fluoranylphenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride

Systemtic Name: 1-[4-(4-fluoranylphenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Openeye Name: 1-[4-(4-fluorophenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride CAS Name: 1-[4-(4-fluorophenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride IUPAC Name: 1-[4-(4-fluorophenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Traditional Name: 1-[4-(4-fluorophenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Formula: C21H28ClFN2O2 MolecularWeight: 394.910623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCOC3=CC=C(C=C3)F.[Cl-]

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCOC3=CC=C(C=C3)F.[Cl-]

InChI

InChI=1S/C21H27FN2O2.ClH/c1-25-21-7-3-2-6-20(21)24-15-13-23(14-16-24)12-4-5-17-26-19-10-8-18(22)9-11-19;/h2-3,6-11H,4-5,12-17H2,1H3;1H