2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-1-(3,4,5-trimethoxyphenyl)ethanone Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H17NO5S/c1-20-13-8-11(9-14(21-2)16(13)22-3)12(18)10-23-15-6-4-5-7-17(15)19/h4-9H,10H2,1-3H3