(2-methyl-5-morpholin-4-ium-4-yl-pent-3-yn-2-yl) ethanoate

Systemtic Name: (2-methyl-5-morpholin-4-ium-4-yl-pent-3-yn-2-yl) ethanoate Openeye Name: (1,1-dimethyl-4-morpholin-4-ium-4-yl-but-2-ynyl) acetate CAS Name: acetic acid [2-methyl-5-(4-morpholin-4-iumyl)pent-3-yn-2-yl] ester IUPAC Name: (2-methyl-5-morpholin-4-ium-4-ylpent-3-yn-2-yl) acetate Traditional Name: acetic acid (1,1-dimethyl-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO3/c1-11(14)16-12(2,3)5-4-6-13-7-9-15-10-8-13/h6-10H2,1-3H3/p+1