heptanoate; 2-hydroxyethyl(trimethyl)azanium; iodide

Systemtic Name: heptanoate; 2-hydroxyethyl(trimethyl)azanium; iodide Openeye Name: heptanoate; 2-hydroxyethyl(trimethyl)ammonium; iodide CAS Name: heptanoate; 2-hydroxyethyl(trimethyl)ammonium; iodide IUPAC Name: heptanoate; 2-hydroxyethyl(trimethyl)azanium; iodide Traditional Name: enanthate; 2-hydroxyethyl(trimethyl)ammonium; iodide Formula: C12H27INO3- MolecularWeight: 360.25215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)[O-].C[N+](C)(C)CCO.[I-]

Isomeric SMILES

CCCCCCC(=O)[O-].C[N+](C)(C)CCO.[I-]

InChI

InChI=1S/C7H14O2.C5H14NO.HI/c1-2-3-4-5-6-7(8)9;1-6(2,3)4-5-7;/h2-6H2,1H3,(H,8,9);7H,4-5H2,1-3H3;1H/q;+1;/p-2