dimethyl-(2-octanoyloxy-4-oxidanyl-4-oxidanylidene-butyl)-(trideuteriomethyl)azanium

Systemtic Name: dimethyl-(2-octanoyloxy-4-oxidanyl-4-oxidanylidene-butyl)-(trideuteriomethyl)azanium Openeye Name: (4-hydroxy-2-octanoyloxy-4-oxo-butyl)-dimethyl-(trideuteriomethyl)ammonium CAS Name: [4-hydroxy-4-oxo-2-(1-oxooctoxy)butyl]-dimethyl-(trideuteriomethyl)ammonium IUPAC Name: (4-hydroxy-2-octanoyloxy-4-oxobutyl)-dimethyl-(trideuteriomethyl)azanium Traditional Name: (2-caprylyloxy-4-hydroxy-4-keto-butyl)-dimethyl-(trideuteriomethyl)ammonium Formula: C15H30NO4+ MolecularWeight: 291.421485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CC(=O)O)C[N+](C)(C)C

Isomeric SMILES

[2H]C([2H])([2H])[N+](C)(C)CC(CC(=O)O)OC(=O)CCCCCCC

InChI

InChI=1S/C15H29NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h13H,5-12H2,1-4H3/p+1/i2D3