[4-butyl-4-[[4-(trifluoromethyloxy)-1H-imidazol-5-yl]methyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-butyl-4-[[4-(trifluoromethyloxy)-1H-imidazol-5-yl]methyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-butyl-4-[[4-(trifluoromethoxy)-1H-imidazol-5-yl]methyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone CAS Name: [4-butyl-4-[[4-(trifluoromethoxy)-1H-imidazol-5-yl]methyl]-1-piperazin-4-iumyl]-(1-naphthalenyl)methanone IUPAC Name: [4-butyl-4-[[4-(trifluoromethoxy)-1H-imidazol-5-yl]methyl]piperazin-4-ium-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-butyl-4-[[4-(trifluoromethoxy)-1H-imidazol-5-yl]methyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone Formula: C24H28F3N4O2+ MolecularWeight: 461.49993

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)CC4=C(N=CN4)OC(F)(F)F

Isomeric SMILES

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)CC4=C(N=CN4)OC(F)(F)F

InChI

InChI=1S/C24H28F3N4O2/c1-2-3-13-31(16-21-22(29-17-28-21)33-24(25,26)27)14-11-30(12-15-31)23(32)20-10-6-8-18-7-4-5-9-19(18)20/h4-10,17H,2-3,11-16H2,1H3,(H,28,29)/q+1