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

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

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CC1C(=O)NCC[NH+]1CC2=CC=CC=C2F

Isomeric SMILES

COCCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CC=C2F

InChI

InChI=1S/C17H24FN3O3/c1-24-10-4-7-19-16(22)11-15-17(23)20-8-9-21(15)12-13-5-2-3-6-14(13)18/h2-3,5-6,15H,4,7-12H2,1H3,(H,19,22)(H,20,23)/p+1/t15-/m1/s1