N-(cyclopenten-1-yl)-2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-ethyl-ethanamide

Systemtic Name: N-(cyclopenten-1-yl)-2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-ethyl-ethanamide Openeye Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-ethyl-acetamide CAS Name: 2-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]-N-(1-cyclopentenyl)-N-ethylacetamide IUPAC Name: 2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-ethylacetamide Traditional Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-ethyl-acetamide Formula: C21H29FN3O2+ MolecularWeight: 374.472263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CCCC1)C(=O)C[NH+]2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

Isomeric SMILES

CCN(C1=CCCC1)C(=O)C[NH+]2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

InChI

InChI=1S/C21H28FN3O2/c1-3-25(18-6-4-5-7-18)21(27)15-23-10-12-24(13-11-23)20-9-8-17(16(2)26)14-19(20)22/h6,8-9,14H,3-5,7,10-13,15H2,1-2H3/p+1