2-[(2R)-3-oxidanylidene-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]-N-(2-propan-2-yloxyethyl)ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]-N-(2-propan-2-yloxyethyl)ethanamide Openeye Name: N-(2-isopropoxyethyl)-2-[(2R)-3-oxo-1-(2-pyridylmethyl)piperazin-1-ium-2-yl]acetamide CAS Name: 2-[(2R)-3-oxo-1-(2-pyridinylmethyl)-2-piperazin-1-iumyl]-N-(2-propan-2-yloxyethyl)acetamide IUPAC Name: 2-[(2R)-3-oxo-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]-N-(2-propan-2-yloxyethyl)acetamide Traditional Name: N-(2-isopropoxyethyl)-2-[(2R)-3-keto-1-(2-pyridylmethyl)piperazin-1-ium-2-yl]acetamide Formula: C17H27N4O3+ MolecularWeight: 335.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC(=O)CC1C(=O)NCC[NH+]1CC2=CC=CC=N2

Isomeric SMILES

CC(C)OCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CC=N2

InChI

InChI=1S/C17H26N4O3/c1-13(2)24-10-8-19-16(22)11-15-17(23)20-7-9-21(15)12-14-5-3-4-6-18-14/h3-6,13,15H,7-12H2,1-2H3,(H,19,22)(H,20,23)/p+1/t15-/m1/s1