4-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]sulfonyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]sulfonyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[(1,1-diketo-1,4-thiazinan-4-yl)sulfonyl]-1H-pyrrole-2-carboxylic acid Formula: C9H12N2O6S2 MolecularWeight: 308.33138

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1S(=O)(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CCN1S(=O)(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C9H12N2O6S2/c12-9(13)8-5-7(6-10-8)19(16,17)11-1-3-18(14,15)4-2-11/h5-6,10H,1-4H2,(H,12,13)