N-cyclohexyl-4-[[1-(4-fluorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[[1-(4-fluorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-cyclohexyl-4-[[1-(4-fluorophenyl)tetrazol-5-yl]methyl]piperazin-4-ium-1-carboxamide CAS Name: N-cyclohexyl-4-[[1-(4-fluorophenyl)-5-tetrazolyl]methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-cyclohexyl-4-[[1-(4-fluorophenyl)tetrazol-5-yl]methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-cyclohexyl-4-[[1-(4-fluorophenyl)tetrazol-5-yl]methyl]piperazin-4-ium-1-carboxamide Formula: C19H27FN7O+ MolecularWeight: 388.462383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=NN=NN3C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=NN=NN3C4=CC=C(C=C4)F

InChI

InChI=1S/C19H26FN7O/c20-15-6-8-17(9-7-15)27-18(22-23-24-27)14-25-10-12-26(13-11-25)19(28)21-16-4-2-1-3-5-16/h6-9,16H,1-5,10-14H2,(H,21,28)/p+1