(3-carboxy-5,5-dimethyl-2-oxidanyl-4-oxidanylidene-hexyl)-trimethyl-azanium

Systemtic Name: (3-carboxy-5,5-dimethyl-2-oxidanyl-4-oxidanylidene-hexyl)-trimethyl-azanium Openeye Name: (3-carboxy-2-hydroxy-5,5-dimethyl-4-oxo-hexyl)-trimethyl-ammonium CAS Name: (3-carboxy-2-hydroxy-5,5-dimethyl-4-oxohexyl)-trimethylammonium IUPAC Name: (3-carboxy-2-hydroxy-5,5-dimethyl-4-oxohexyl)-trimethylazanium Traditional Name: (3-carboxy-2-hydroxy-4-keto-5,5-dimethyl-hexyl)-trimethyl-ammonium Formula: C12H24NO4+ MolecularWeight: 246.32326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO4/c1-12(2,3)10(15)9(11(16)17)8(14)7-13(4,5)6/h8-9,14H,7H2,1-6H3/p+1