2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-2-methyl-propanamide

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-2-methyl-propanamide Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-2-methyl-propanamide CAS Name: 2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-2-methylpropanamide IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-2-methylpropanamide Traditional Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-2-methyl-propionamide Formula: C14H21FN3O+ MolecularWeight: 266.334443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20FN3O/c1-14(2,13(16)19)18-9-7-17(8-10-18)12-5-3-11(15)4-6-12/h3-6H,7-10H2,1-2H3,(H2,16,19)/p+1