2-methyl-7-morpholin-4-ium-4-yl-hepta-3,5-diyn-2-ol

Systemtic Name: 2-methyl-7-morpholin-4-ium-4-yl-hepta-3,5-diyn-2-ol Openeye Name: 2-methyl-7-morpholin-4-ium-4-yl-hepta-3,5-diyn-2-ol CAS Name: 2-methyl-7-(4-morpholin-4-iumyl)-2-hepta-3,5-diynol IUPAC Name: 2-methyl-7-morpholin-4-ium-4-ylhepta-3,5-diyn-2-ol Traditional Name: 2-methyl-7-morpholin-4-ium-4-yl-hepta-3,5-diyn-2-ol Formula: C12H18NO2+ MolecularWeight: 208.27682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-12(2,14)6-4-3-5-7-13-8-10-15-11-9-13/h14H,7-11H2,1-2H3/p+1