1-(2-morpholin-4-ium-4-ylethyl)-N-[(1S)-1-pyridin-4-ylpropyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(1S)-1-pyridin-4-ylpropyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(1S)-1-(4-pyridyl)propyl]triazole-4-carboxamide CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-N-[(1S)-1-pyridin-4-ylpropyl]-4-triazolecarboxamide IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(1S)-1-pyridin-4-ylpropyl]triazole-4-carboxamide Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(1S)-1-(4-pyridyl)propyl]triazole-4-carboxamide Formula: C17H25N6O2+ MolecularWeight: 345.4194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NC=C1)NC(=O)C2=CN(N=N2)CC[NH+]3CCOCC3

Isomeric SMILES

CC[C@@H](C1=CC=NC=C1)NC(=O)C2=CN(N=N2)CC[NH+]3CCOCC3

InChI

InChI=1S/C17H24N6O2/c1-2-15(14-3-5-18-6-4-14)19-17(24)16-13-23(21-20-16)8-7-22-9-11-25-12-10-22/h3-6,13,15H,2,7-12H2,1H3,(H,19,24)/p+1/t15-/m0/s1