1-(2-ethoxy-3-hexadecoxy-propyl)-1-methyl-piperidin-1-ium-4-ol iodide

Systemtic Name: 1-(2-ethoxy-3-hexadecoxy-propyl)-1-methyl-piperidin-1-ium-4-ol iodide Openeye Name: 1-(2-ethoxy-3-hexadecoxy-propyl)-1-methyl-piperidin-1-ium-4-ol iodide CAS Name: 1-(2-ethoxy-3-hexadecoxypropyl)-1-methyl-4-piperidin-1-iumol iodide IUPAC Name: 1-(2-ethoxy-3-hexadecoxypropyl)-1-methylpiperidin-1-ium-4-ol iodide Traditional Name: 1-(3-cetyloxy-2-ethoxy-propyl)-1-methyl-piperidin-1-ium-4-ol iodide Formula: C27H56INO3 MolecularWeight: 569.64291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(C[N+]1(CCC(CC1)O)C)OCC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(C[N+]1(CCC(CC1)O)C)OCC.[I-]

InChI

InChI=1S/C27H56NO3.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-30-25-27(31-5-2)24-28(3)21-19-26(29)20-22-28;/h26-27,29H,4-25H2,1-3H3;1H/q+1;/p-1