2-[2-(3-phenylpropylcarbamoyloxy)ethoxy]ethyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: 2-[2-(3-phenylpropylcarbamoyloxy)ethoxy]ethyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: 2-[2-(3-phenylpropylcarbamoyloxy)ethoxy]ethyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-acetyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid 2-[2-[oxo-(3-phenylpropylamino)methoxy]ethoxy]ethyl ester iodide IUPAC Name: 2-[2-(3-phenylpropylcarbamoyloxy)ethoxy]ethyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid 2-[2-(3-phenylpropylcarbamoyloxy)ethoxy]ethyl ester iodide Formula: C25H34IN3O6 MolecularWeight: 599.45843

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCOCCOC(=O)NCCCC2=CC=CC=C2.[I-]

Isomeric SMILES

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCOCCOC(=O)NCCCC2=CC=CC=C2.[I-]

InChI

InChI=1S/C25H33N3O6.HI/c1-3-27-15-8-7-13-23(27)20-28(21(2)29)25(31)34-19-17-32-16-18-33-24(30)26-14-9-12-22-10-5-4-6-11-22;/h4-8,10-11,13,15H,3,9,12,14,16-20H2,1-2H3;1H