(3-carboxy-6-methyl-2-oxidanyl-4-oxidanylidene-heptyl)-trimethyl-azanium

Systemtic Name: (3-carboxy-6-methyl-2-oxidanyl-4-oxidanylidene-heptyl)-trimethyl-azanium Openeye Name: (3-carboxy-2-hydroxy-6-methyl-4-oxo-heptyl)-trimethyl-ammonium CAS Name: (3-carboxy-2-hydroxy-6-methyl-4-oxoheptyl)-trimethylammonium IUPAC Name: (3-carboxy-2-hydroxy-6-methyl-4-oxoheptyl)-trimethylazanium Traditional Name: (3-carboxy-2-hydroxy-4-keto-6-methyl-heptyl)-trimethyl-ammonium Formula: C12H24NO4+ MolecularWeight: 246.32326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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