N-[2-(2-methoxyphenoxy)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(2-methoxyphenoxy)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(2-methoxyphenoxy)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[2-(2-methoxyphenoxy)ethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[2-(2-methoxyphenoxy)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[2-(2-methoxyphenoxy)ethyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCNC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

COC1=CC=CC=C1OCCNC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H18N2O4S/c1-21-13-6-2-3-7-14(13)22-11-9-17-15(19)12-23-16-8-4-5-10-18(16)20/h2-8,10H,9,11-12H2,1H3,(H,17,19)