N-(3-fluorophenyl)-2-[4-(3-phenylpropanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(3-phenylpropanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(3-phenylpropanoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-(1-oxo-3-phenylpropyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(3-phenylpropanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-(4-hydrocinnamoylpiperazin-1-ium-1-yl)acetamide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H24FN3O2/c22-18-7-4-8-19(15-18)23-20(26)16-24-11-13-25(14-12-24)21(27)10-9-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2,(H,23,26)/p+1