3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methylphenyl)propanamide

Systemtic Name: 3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methylphenyl)propanamide Openeye Name: 3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(o-tolyl)propanamide CAS Name: 3-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-N-(2-methylphenyl)propanamide IUPAC Name: 3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methylphenyl)propanamide Traditional Name: 3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(o-tolyl)propionamide Formula: C20H25FN3O+ MolecularWeight: 342.430403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C20H24FN3O/c1-16-6-2-4-8-18(16)22-20(25)10-11-23-12-14-24(15-13-23)19-9-5-3-7-17(19)21/h2-9H,10-15H2,1H3,(H,22,25)/p+1