2-[(2S)-1-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperidin-2-yl]ethanamide

Systemtic Name: 2-[(2S)-1-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperidin-2-yl]ethanamide Openeye Name: 2-[(2S)-1-[5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-2-piperidyl]acetamide CAS Name: 2-[(2S)-1-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridin-1-iumyl]-2-piperidinyl]acetamide IUPAC Name: 2-[(2S)-1-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperidin-2-yl]acetamide Traditional Name: 2-[(2S)-1-[5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-2-piperidyl]acetamide Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)N3CCCCC3CC(=O)N

Isomeric SMILES

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)N3CCCC[C@H]3CC(=O)N

InChI

InChI=1S/C17H23N5O2/c1-11(2)16-20-17(24-21-16)12-6-7-15(19-10-12)22-8-4-3-5-13(22)9-14(18)23/h6-7,10-11,13H,3-5,8-9H2,1-2H3,(H2,18,23)/p+1/t13-/m0/s1