2-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-(6-chloropyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[(6-chloro-3-pyridinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-(6-chloropyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-(6-chloronicotinoyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Formula: C18H19ClFN4O2+ MolecularWeight: 377.820463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H18ClFN4O2/c19-16-6-1-13(11-21-16)18(26)24-9-7-23(8-10-24)12-17(25)22-15-4-2-14(20)3-5-15/h1-6,11H,7-10,12H2,(H,22,25)/p+1