[3-carboxy-6-methyl-2,7-bis(oxidanyl)-4-oxidanylidene-heptyl]-trimethyl-azanium

Systemtic Name: [3-carboxy-6-methyl-2,7-bis(oxidanyl)-4-oxidanylidene-heptyl]-trimethyl-azanium Openeye Name: (3-carboxy-2,7-dihydroxy-6-methyl-4-oxo-heptyl)-trimethyl-ammonium CAS Name: (3-carboxy-2,7-dihydroxy-6-methyl-4-oxoheptyl)-trimethylammonium IUPAC Name: (3-carboxy-2,7-dihydroxy-6-methyl-4-oxoheptyl)-trimethylazanium Traditional Name: (3-carboxy-2,7-dihydroxy-4-keto-6-methyl-heptyl)-trimethyl-ammonium Formula: C12H24NO5+ MolecularWeight: 262.32266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO5/c1-8(7-14)5-9(15)11(12(17)18)10(16)6-13(2,3)4/h8,10-11,14,16H,5-7H2,1-4H3/p+1