1-[(2-chlorophenyl)methyl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)triazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-4-triazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)triazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)triazole-4-carboxamide Formula: C18H25ClN5O2+ MolecularWeight: 378.8764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CN(N=N1)CC2=CC=CC=C2Cl)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CN(N=N1)CC2=CC=CC=C2Cl)[NH+]3CCOCC3

InChI

InChI=1S/C18H24ClN5O2/c1-18(2,23-7-9-26-10-8-23)13-20-17(25)16-12-24(22-21-16)11-14-5-3-4-6-15(14)19/h3-6,12H,7-11,13H2,1-2H3,(H,20,25)/p+1