3-[(3R)-3-methyl-6-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]hex-4-yn-3-yl]oxypropanenitrile

Systemtic Name: 3-[(3R)-3-methyl-6-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]hex-4-yn-3-yl]oxypropanenitrile Openeye Name: 3-[(1R)-1-ethyl-1-methyl-4-[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]but-2-ynoxy]propanenitrile CAS Name: 3-[(3R)-3-methyl-6-[(2R)-2-(3-pyridinyl)-1-piperidin-1-iumyl]hex-4-yn-3-yl]oxypropanenitrile IUPAC Name: 3-[(3R)-3-methyl-6-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]hex-4-yn-3-yl]oxypropanenitrile Traditional Name: 3-[(1R)-1-ethyl-1-methyl-4-[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]but-2-ynoxy]propionitrile Formula: C20H28N3O+ MolecularWeight: 326.45582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CC[NH+]1CCCCC1C2=CN=CC=C2)OCCC#N

Isomeric SMILES

CC[C@](C)(C#CC[NH+]1CCCC[C@@H]1C2=CN=CC=C2)OCCC#N

InChI

InChI=1S/C20H27N3O/c1-3-20(2,24-16-8-12-21)11-7-15-23-14-5-4-10-19(23)18-9-6-13-22-17-18/h6,9,13,17,19H,3-5,8,10,14-16H2,1-2H3/p+1/t19-,20-/m1/s1