(3R)-3-ethyl-1-methyl-4-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperazin-2-one

Systemtic Name: (3R)-3-ethyl-1-methyl-4-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperazin-2-one Openeye Name: (3R)-3-ethyl-4-[5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1-methyl-piperazin-2-one CAS Name: (3R)-3-ethyl-1-methyl-4-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridin-1-iumyl]-2-piperazinone IUPAC Name: (3R)-3-ethyl-1-methyl-4-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]piperazin-2-one Traditional Name: (3R)-3-ethyl-4-[5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1-methyl-piperazin-2-one Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CCN1C2=[NH+]C=C(C=C2)C3=NC(=NO3)C(C)C)C

Isomeric SMILES

CC[C@@H]1C(=O)N(CCN1C2=[NH+]C=C(C=C2)C3=NC(=NO3)C(C)C)C

InChI

InChI=1S/C17H23N5O2/c1-5-13-17(23)21(4)8-9-22(13)14-7-6-12(10-18-14)16-19-15(11(2)3)20-24-16/h6-7,10-11,13H,5,8-9H2,1-4H3/p+1/t13-/m1/s1