2-(4-fluoranylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(4-fluoranylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(4-fluorophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(4-fluorophenoxy)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(4-fluorophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(4-fluorophenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C13H18FN2O2+ MolecularWeight: 253.292623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)F

InChI

InChI=1S/C13H17FN2O2/c1-15-6-8-16(9-7-15)13(17)10-18-12-4-2-11(14)3-5-12/h2-5H,6-10H2,1H3/p+1