4-but-3-ynyl-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-but-3-ynyl-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-but-3-ynyl-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-but-3-ynyl-N-(4-fluorophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-but-3-ynyl-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-but-3-ynyl-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Formula: C15H19FN3O+ MolecularWeight: 276.329263

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC[NH+]1CCN(CC1)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C#CCC[NH+]1CCN(CC1)C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C15H18FN3O/c1-2-3-8-18-9-11-19(12-10-18)15(20)17-14-6-4-13(16)5-7-14/h1,4-7H,3,8-12H2,(H,17,20)/p+1