2-(benzimidazol-1-ylmethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(benzimidazol-1-ylmethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(benzimidazol-1-ylmethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]oxazole-4-carboxamide CAS Name: 2-(1-benzimidazolylmethyl)-N-[[1-(4-morpholin-4-iumyl)cyclopentyl]methyl]-4-oxazolecarboxamide IUPAC Name: 2-(benzimidazol-1-ylmethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-(benzimidazol-1-ylmethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]oxazole-4-carboxamide Formula: C22H28N5O3+ MolecularWeight: 410.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CNC(=O)C2=COC(=N2)CN3C=NC4=CC=CC=C43)[NH+]5CCOCC5

Isomeric SMILES

C1CCC(C1)(CNC(=O)C2=COC(=N2)CN3C=NC4=CC=CC=C43)[NH+]5CCOCC5

InChI

InChI=1S/C22H27N5O3/c28-21(23-15-22(7-3-4-8-22)27-9-11-29-12-10-27)18-14-30-20(25-18)13-26-16-24-17-5-1-2-6-19(17)26/h1-2,5-6,14,16H,3-4,7-13,15H2,(H,23,28)/p+1