(3R)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]oxolan-2-one

Systemtic Name: (3R)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]oxolan-2-one Openeye Name: (3R)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]tetrahydrofuran-2-one CAS Name: (3R)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazin-1-iumyl]-2-oxolanone IUPAC Name: (3R)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]oxolan-2-one Traditional Name: (3R)-3-(4-piazthiol-4-ylsulfonylpiperazin-1-ium-1-yl)tetrahydrofuran-2-one Formula: C14H17N4O4S2+ MolecularWeight: 369.43918

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1COC(=O)[C@@H]1[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C14H16N4O4S2/c19-14-11(4-9-22-14)17-5-7-18(8-6-17)24(20,21)12-3-1-2-10-13(12)16-23-15-10/h1-3,11H,4-9H2/p+1/t11-/m1/s1