(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-oxopiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-oxo-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-oxopiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(3-ketopiperazin-1-ium-1-yl)propionamide Formula: C15H21FN3O2+ MolecularWeight: 294.344543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)F)[NH+]2CCNC(=O)C2

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=C(C=C1)F)[NH+]2CCNC(=O)C2

InChI

InChI=1S/C15H20FN3O2/c1-11(19-9-8-17-14(20)10-19)15(21)18-7-6-12-2-4-13(16)5-3-12/h2-5,11H,6-10H2,1H3,(H,17,20)(H,18,21)/p+1/t11-/m1/s1