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

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-[(3S)-1-methylpyrrolidin-1-ium-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-[(3S)-1-methylpyrrolidin-1-ium-3-yl]triazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-[(3S)-1-methyl-3-pyrrolidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-[(3S)-1-methylpyrrolidin-1-ium-3-yl]triazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-methyl-N-[(3S)-1-methylpyrrolidin-1-ium-3-yl]triazole-4-carboxamide Formula: C16H21ClN5O+ MolecularWeight: 334.82384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(C1)N(C)C(=O)C2=CN(N=N2)CC3=CC=CC=C3Cl

Isomeric SMILES

C[NH+]1CC[C@@H](C1)N(C)C(=O)C2=CN(N=N2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C16H20ClN5O/c1-20-8-7-13(10-20)21(2)16(23)15-11-22(19-18-15)9-12-5-3-4-6-14(12)17/h3-6,11,13H,7-10H2,1-2H3/p+1/t13-/m0/s1