2-[4-[4-(diethylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[4-(diethylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[[4-(diethylamino)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Formula: C23H30FN4O2+ MolecularWeight: 413.508303

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C23H29FN4O2/c1-3-27(4-2)21-11-5-18(6-12-21)23(30)28-15-13-26(14-16-28)17-22(29)25-20-9-7-19(24)8-10-20/h5-12H,3-4,13-17H2,1-2H3,(H,25,29)/p+1