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

Systemtic Name: 2-[4-(3-cyanophenyl)carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-(3-cyanobenzoyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[(3-cyanophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-(3-cyanobenzoyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-(3-cyanobenzoyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Formula: C20H20FN4O2+ MolecularWeight: 367.396803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19FN4O2/c21-17-4-6-18(7-5-17)23-19(26)14-24-8-10-25(11-9-24)20(27)16-3-1-2-15(12-16)13-22/h1-7,12H,8-11,14H2,(H,23,26)/p+1