3-[1,3-bis(oxidanyl)-1,3-bis(oxidanylidene)propan-2-yl]benzenesulfonate

Systemtic Name: 3-[1,3-bis(oxidanyl)-1,3-bis(oxidanylidene)propan-2-yl]benzenesulfonate Openeye Name: 3-(1-carboxy-2-hydroxy-2-oxo-ethyl)benzenesulfonate CAS Name: 3-(1,3-dihydroxy-1,3-dioxopropan-2-yl)benzenesulfonate IUPAC Name: 3-(1,3-dihydroxy-1,3-dioxopropan-2-yl)benzenesulfonate Traditional Name: 3-(1-carboxy-2-hydroxy-2-keto-ethyl)besylate Formula: C9H7O7S- MolecularWeight: 259.21268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8O7S/c10-8(11)7(9(12)13)5-2-1-3-6(4-5)17(14,15)16/h1-4,7H,(H,10,11)(H,12,13)(H,14,15,16)/p-1