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

Systemtic Name: N-(1-cyanocyclopentyl)-2-[4-(4-fluorophenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C19H24FN4O2+ MolecularWeight: 359.417863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN4O2/c20-16-5-3-15(4-6-16)18(26)24-11-9-23(10-12-24)13-17(25)22-19(14-21)7-1-2-8-19/h3-6H,1-2,7-13H2,(H,22,25)/p+1