N-[2-[1-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-N-pyridin-2-yl-cyclohexanecarboxamide

Systemtic Name: N-[2-[1-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-N-pyridin-2-yl-cyclohexanecarboxamide Openeye Name: N-[2-[1-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-N-(2-pyridyl)cyclohexanecarboxamide CAS Name: N-[2-[1-(2-fluorophenyl)-1-piperazin-1-iumyl]ethyl]-N-(2-pyridinyl)cyclohexanecarboxamide IUPAC Name: N-[2-[1-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-N-pyridin-2-ylcyclohexanecarboxamide Traditional Name: N-[2-[1-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-N-(2-pyridyl)cyclohexanecarboxamide Formula: C24H32FN4O+ MolecularWeight: 411.535483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC[N+]2(CCNCC2)C3=CC=CC=C3F)C4=CC=CC=N4

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC[N+]2(CCNCC2)C3=CC=CC=C3F)C4=CC=CC=N4

InChI

InChI=1S/C24H32FN4O/c25-21-10-4-5-11-22(21)29(17-14-26-15-18-29)19-16-28(23-12-6-7-13-27-23)24(30)20-8-2-1-3-9-20/h4-7,10-13,20,26H,1-3,8-9,14-19H2/q+1