N-propan-2-yl-1-[2-[(2R)-1-(pyridin-3-ylmethyl)piperidin-1-ium-2-yl]ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-propan-2-yl-1-[2-[(2R)-1-(pyridin-3-ylmethyl)piperidin-1-ium-2-yl]ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[2-[(2R)-1-(3-pyridylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide CAS Name: N-propan-2-yl-1-[2-[(2R)-1-(3-pyridinylmethyl)-2-piperidin-1-iumyl]ethyl]-4-triazolecarboxamide IUPAC Name: N-propan-2-yl-1-[2-[(2R)-1-(pyridin-3-ylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide Traditional Name: N-isopropyl-1-[2-[(2R)-1-(3-pyridylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide Formula: C19H29N6O+ MolecularWeight: 357.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)CCC2CCCC[NH+]2CC3=CN=CC=C3

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)CC[C@H]2CCCC[NH+]2CC3=CN=CC=C3

InChI

InChI=1S/C19H28N6O/c1-15(2)21-19(26)18-14-25(23-22-18)11-8-17-7-3-4-10-24(17)13-16-6-5-9-20-12-16/h5-6,9,12,14-15,17H,3-4,7-8,10-11,13H2,1-2H3,(H,21,26)/p+1/t17-/m1/s1