3-[2-[ethanoyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxyethoxy]propyl 2,2-dimethylpropanoate

Systemtic Name: 3-[2-[ethanoyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxyethoxy]propyl 2,2-dimethylpropanoate Openeye Name: 3-[2-[acetyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxyethoxy]propyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 3-[2-[[acetyl-[(1-ethyl-2-pyridin-1-iumyl)methyl]amino]-oxomethoxy]ethoxy]propyl ester IUPAC Name: 3-[2-[acetyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxyethoxy]propyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 3-[2-[acetyl-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamoyl]oxyethoxy]propyl ester Formula: C21H33N2O6+ MolecularWeight: 409.49652

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCOCCCOC(=O)C(C)(C)C

Isomeric SMILES

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCOCCCOC(=O)C(C)(C)C

InChI

InChI=1S/C21H33N2O6/c1-6-22-11-8-7-10-18(22)16-23(17(2)24)20(26)29-15-14-27-12-9-13-28-19(25)21(3,4)5/h7-8,10-11H,6,9,12-16H2,1-5H3/q+1