(2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfo-ethanoic acid

Systemtic Name: (2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfo-ethanoic acid Openeye Name: (2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfo-acetic acid CAS Name: (2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfoacetic acid IUPAC Name: (2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfoacetic acid Traditional Name: (2E)-2-(1,3-dithiolan-2-ylimino)-2-sulfo-acetic acid Formula: C5H7NO5S3 MolecularWeight: 257.30778

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)N=C(C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1CSC(S1)/N=C(\C(=O)O)/S(=O)(=O)O

InChI

InChI=1S/C5H7NO5S3/c7-4(8)3(14(9,10)11)6-5-12-1-2-13-5/h5H,1-2H2,(H,7,8)(H,9,10,11)/b6-3+