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terephthalate; trimethyl(3-oxidanylpropyl)azanium; iodide

terephthalate; trimethyl(3-oxidanylpropyl)azanium; iodide

Systemtic Name:terephthalate; trimethyl(3-oxidanylpropyl)azanium; iodide
Openeye Name:3-hydroxypropyl(trimethyl)ammonium; terephthalate; iodide
CAS Name:3-hydroxypropyl(trimethyl)ammonium; terephthalate; iodide
IUPAC Name:3-hydroxypropyl(trimethyl)azanium; terephthalate; iodide
Traditional Name:3-hydroxypropyl(trimethyl)ammonium; terephthalate; iodide
Formula: C14H20INO5-2
MolecularWeight: 409.21677
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCO.C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[I-]


Isomeric SMILES

C[N+](C)(C)CCCO.C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[I-]


InChI

InChI=1S/C8H6O4.C6H16NO.HI/c9-7(10)5-1-2-6(4-3-5)8(11)12;1-7(2,3)5-4-6-8;/h1-4H,(H,9,10)(H,11,12);8H,4-6H2,1-3H3;1H/q;+1;/p-3


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