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1-methylsulfanyl-5-oxidanylidene-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid

1-methylsulfanyl-5-oxidanylidene-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid

Systemtic Name:1-methylsulfanyl-5-oxidanylidene-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid
Openeye Name:1-methylsulfanyl-5-oxo-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid
CAS Name:1-(methylthio)-5-oxo-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid
IUPAC Name:1-methylsulfanyl-5-oxo-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid
Traditional Name:5-keto-1-(methylthio)-2,3,3a,4,6,6a-hexahydropyrrolo[3,2-b]pyrrol-1-ium-1-carboxylic acid
Formula: C8H13N2O3S+
MolecularWeight: 217.26542
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Descriptors Computed from Structure

Canonical SMILES:

CS[N+]1(CCC2C1CC(=O)N2)C(=O)O


Isomeric SMILES

CS[N+]1(CCC2C1CC(=O)N2)C(=O)O


InChI

InChI=1S/C8H12N2O3S/c1-14-10(8(12)13)3-2-5-6(10)4-7(11)9-5/h5-6H,2-4H2,1H3,(H-,9,11,12,13)/p+1


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