N-ethyl-2-[(2R)-1-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-hydroxyethyl)ethanamide

Systemtic Name: N-ethyl-2-[(2R)-1-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-hydroxyethyl)ethanamide Openeye Name: N-ethyl-2-[(2R)-1-[(3-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-hydroxyethyl)acetamide CAS Name: N-ethyl-2-[(2R)-1-[(3-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-hydroxyethyl)acetamide IUPAC Name: N-ethyl-2-[(2R)-1-[(3-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-hydroxyethyl)acetamide Traditional Name: N-ethyl-2-[(2R)-1-(3-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(2-hydroxyethyl)acetamide Formula: C17H25FN3O3+ MolecularWeight: 338.397103

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C(=O)CC1C(=O)NCC[NH+]1CC2=CC(=CC=C2)F

Isomeric SMILES

CCN(CCO)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC(=CC=C2)F

InChI

InChI=1S/C17H24FN3O3/c1-2-20(8-9-22)16(23)11-15-17(24)19-6-7-21(15)12-13-4-3-5-14(18)10-13/h3-5,10,15,22H,2,6-9,11-12H2,1H3,(H,19,24)/p+1/t15-/m1/s1