N-ethyl-2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)ethanamide

Systemtic Name: N-ethyl-2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)ethanamide Openeye Name: N-ethyl-2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-methylallyl)acetamide CAS Name: N-ethyl-2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-methylprop-2-enyl)acetamide IUPAC Name: N-ethyl-2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-methylprop-2-enyl)acetamide Traditional Name: N-ethyl-2-[(2R)-1-(4-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(2-methylallyl)acetamide Formula: C19H27FN3O2+ MolecularWeight: 348.434983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26FN3O2/c1-4-22(12-14(2)3)18(24)11-17-19(25)21-9-10-23(17)13-15-5-7-16(20)8-6-15/h5-8,17H,2,4,9-13H2,1,3H3,(H,21,25)/p+1/t17-/m1/s1