[(3R)-6-morpholin-4-ium-4-ylhex-4-yn-3-yl] ethanoate

Systemtic Name: [(3R)-6-morpholin-4-ium-4-ylhex-4-yn-3-yl] ethanoate Openeye Name: [(1R)-1-ethyl-4-morpholin-4-ium-4-yl-but-2-ynyl] acetate CAS Name: acetic acid [(3R)-6-(4-morpholin-4-iumyl)hex-4-yn-3-yl] ester IUPAC Name: [(3R)-6-morpholin-4-ium-4-ylhex-4-yn-3-yl] acetate Traditional Name: acetic acid [(1R)-1-ethyl-4-morpholin-4-ium-4-yl-but-2-ynyl] ester Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC[NH+]1CCOCC1)OC(=O)C

Isomeric SMILES

CC[C@H](C#CC[NH+]1CCOCC1)OC(=O)C

InChI

InChI=1S/C12H19NO3/c1-3-12(16-11(2)14)5-4-6-13-7-9-15-10-8-13/h12H,3,6-10H2,1-2H3/p+1/t12-/m1/s1