1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate

Systemtic Name: 1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate Openeye Name: 1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate CAS Name: 1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate IUPAC Name: 1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate Traditional Name: 1-sulfocyclohexa-3,5-diene-1,2-dicarboxylate Formula: C8H6O7S-2 MolecularWeight: 246.19404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(C=C1)(C(=O)[O-])S(=O)(=O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(C(C=C1)(C(=O)[O-])S(=O)(=O)O)C(=O)[O-]

InChI

InChI=1S/C8H8O7S/c9-6(10)5-3-1-2-4-8(5,7(11)12)16(13,14)15/h1-5H,(H,9,10)(H,11,12)(H,13,14,15)/p-2