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

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]sulfonyl]-1-ethyl-pyrrole-2-carboxylic acid Openeye Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1-ethyl-pyrrole-2-carboxylic acid CAS Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1-ethyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-1-ethylpyrrole-2-carboxylic acid Traditional Name: 4-[(1,1-diketo-1,4-thiazinan-4-yl)sulfonyl]-1-ethyl-pyrrole-2-carboxylic acid Formula: C11H16N2O6S2 MolecularWeight: 336.38454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CCS(=O)(=O)CC2

Isomeric SMILES

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CCS(=O)(=O)CC2

InChI

InChI=1S/C11H16N2O6S2/c1-2-12-8-9(7-10(12)11(14)15)21(18,19)13-3-5-20(16,17)6-4-13/h7-8H,2-6H2,1H3,(H,14,15)