2-[2-(heptadecylcarbamoyloxy)ethoxy]ethyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: 2-[2-(heptadecylcarbamoyloxy)ethoxy]ethyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: 2-[2-(heptadecylcarbamoyloxy)ethoxy]ethyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid 2-[2-[(heptadecylamino)-oxomethoxy]ethoxy]ethyl ester iodide IUPAC Name: 2-[2-(heptadecylcarbamoyloxy)ethoxy]ethyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid 2-[2-(heptadecylcarbamoyloxy)ethoxy]ethyl ester iodide Formula: C31H56IN3O5 MolecularWeight: 677.69791

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC(=O)OCCOCCOC(=O)NCC1=CC=CC=[N+]1CC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC(=O)OCCOCCOC(=O)NCC1=CC=CC=[N+]1CC.[I-]

InChI

InChI=1S/C31H55N3O5.HI/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-32-30(35)38-26-24-37-25-27-39-31(36)33-28-29-21-18-20-23-34(29)4-2;/h18,20-21,23H,3-17,19,22,24-28H2,1-2H3,(H-,32,33,35,36);1H