ethyl 2-[1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate Openeye Name: ethyl 2-[1-[(2-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetate CAS Name: 2-[1-[(2-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(2-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]acetate Traditional Name: 2-[1-(2-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]acetic acid ethyl ester Formula: C15H20FN2O3+ MolecularWeight: 295.329303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19FN2O3/c1-2-21-14(19)9-13-15(20)17-7-8-18(13)10-11-5-3-4-6-12(11)16/h3-6,13H,2,7-10H2,1H3,(H,17,20)/p+1