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

Systemtic Name: 3-[(3R)-3-methyl-6-pyrrolidin-1-ium-1-yl-hex-4-yn-3-yl]oxypropanenitrile Openeye Name: 3-[(1R)-1-ethyl-1-methyl-4-pyrrolidin-1-ium-1-yl-but-2-ynoxy]propanenitrile CAS Name: 3-[(3R)-3-methyl-6-(1-pyrrolidin-1-iumyl)hex-4-yn-3-yl]oxypropanenitrile IUPAC Name: 3-[(3R)-3-methyl-6-pyrrolidin-1-ium-1-ylhex-4-yn-3-yl]oxypropanenitrile Traditional Name: 3-[(1R)-1-ethyl-1-methyl-4-pyrrolidin-1-ium-1-yl-but-2-ynoxy]propionitrile Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CC[NH+]1CCCC1)OCCC#N

Isomeric SMILES

CC[C@](C)(C#CC[NH+]1CCCC1)OCCC#N

InChI

InChI=1S/C14H22N2O/c1-3-14(2,17-13-7-9-15)8-6-12-16-10-4-5-11-16/h3-5,7,10-13H2,1-2H3/p+1/t14-/m1/s1