2-ethylsulfanylethyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: 2-ethylsulfanylethyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: 2-ethylsulfanylethyl 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-(ethylthio)ethyl ester iodide IUPAC Name: 2-ethylsulfanylethyl 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-(ethylthio)ethyl ester iodide Formula: C15H23IN2O3S MolecularWeight: 438.32419

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCSCC.[I-]

Isomeric SMILES

CC[N+]1=CC=CC=C1CN(C(=O)C)C(=O)OCCSCC.[I-]

InChI

InChI=1S/C15H23N2O3S.HI/c1-4-16-9-7-6-8-14(16)12-17(13(3)18)15(19)20-10-11-21-5-2;/h6-9H,4-5,10-12H2,1-3H3;1H/q+1;/p-1