3-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[4-[2-(ethylamino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[4-[2-(ethylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[4-[2-(ethylamino)-2-oxoethyl]piperazin-4-ium-1-yl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[4-[2-(ethylamino)-2-keto-ethyl]piperazin-4-ium-1-yl]-N-(2-fluorophenyl)propionamide Formula: C17H26FN4O2+ MolecularWeight: 337.412343

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+]1CCN(CC1)CCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

CCNC(=O)C[NH+]1CCN(CC1)CCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C17H25FN4O2/c1-2-19-17(24)13-22-11-9-21(10-12-22)8-7-16(23)20-15-6-4-3-5-14(15)18/h3-6H,2,7-13H2,1H3,(H,19,24)(H,20,23)/p+1