2-[4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]ethylazanium

Systemtic Name: 2-[4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-[2-(4-fluoroanilino)-2-oxo-ethyl]piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[2-(4-fluoroanilino)-2-oxoethyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-[2-(4-fluoroanilino)-2-keto-ethyl]piperazin-4-ium-1-yl]ethylammonium Formula: C14H23FN4O+2 MolecularWeight: 282.357023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)CC[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)CC[NH3+]

InChI

InChI=1S/C14H21FN4O/c15-12-1-3-13(4-2-12)17-14(20)11-19-9-7-18(6-5-16)8-10-19/h1-4H,5-11,16H2,(H,17,20)/p+2