2-[4-[4-(diethylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[4-(diethylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[[4-(diethylamino)phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-[4-(diethylamino)benzoyl]piperazin-1-ium-1-yl]-N-(3-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(=CC=C3)F

Isomeric SMILES

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

InChI

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