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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(CCN1C2=[NH+]C=C(C=C2)C3=NC(=NO3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O2/c1-4-5-6-14-17(23)21(3)9-10-22(14)15-8-7-13(11-18-15)16-19-12(2)20-24-16/h7-8,11,14H,4-6,9-10H2,1-3H3/p+1/t14-/m1/s1