2-[2,3-bis(oxidanyl)phenyl]carbonyloxyethyl-trimethyl-azanium iodide

Systemtic Name: 2-[2,3-bis(oxidanyl)phenyl]carbonyloxyethyl-trimethyl-azanium iodide Openeye Name: 2-(2,3-dihydroxybenzoyl)oxyethyl-trimethyl-ammonium iodide CAS Name: 2-[(2,3-dihydroxyphenyl)-oxomethoxy]ethyl-trimethylammonium iodide IUPAC Name: 2-(2,3-dihydroxybenzoyl)oxyethyl-trimethylazanium iodide Traditional Name: 2-(2,3-dihydroxybenzoyl)oxyethyl-trimethyl-ammonium iodide Formula: C12H18INO4 MolecularWeight: 367.18009

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(=O)C1=C(C(=CC=C1)O)O.[I-]

Isomeric SMILES

C[N+](C)(C)CCOC(=O)C1=C(C(=CC=C1)O)O.[I-]

InChI

InChI=1S/C12H17NO4.HI/c1-13(2,3)7-8-17-12(16)9-5-4-6-10(14)11(9)15;/h4-6H,7-8H2,1-3H3,(H-,14,15,16);1H