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3-(methylsulfonylmethyl)-1-oxidanidyl-quinoxalin-1-ium-2-carbonitrile

3-(methylsulfonylmethyl)-1-oxidanidyl-quinoxalin-1-ium-2-carbonitrile

Systemtic Name:3-(methylsulfonylmethyl)-1-oxidanidyl-quinoxalin-1-ium-2-carbonitrile
Openeye Name:3-(methylsulfonylmethyl)-1-oxido-quinoxalin-1-ium-2-carbonitrile
CAS Name:3-(methylsulfonylmethyl)-1-oxido-2-quinoxalin-1-iumcarbonitrile
IUPAC Name:3-(methylsulfonylmethyl)-1-oxidoquinoxalin-1-ium-2-carbonitrile
Traditional Name:3-(mesylmethyl)-1-oxido-quinoxalin-1-ium-2-carbonitrile
Formula: C11H9N3O3S
MolecularWeight: 263.27246
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=NC2=CC=CC=C2[N+](=C1C#N)[O-]


Isomeric SMILES

CS(=O)(=O)CC1=NC2=CC=CC=C2[N+](=C1C#N)[O-]


InChI

InChI=1S/C11H9N3O3S/c1-18(16,17)7-9-11(6-12)14(15)10-5-3-2-4-8(10)13-9/h2-5H,7H2,1H3


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