4-tert-butyl-3-methanoyl-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 4-tert-butyl-3-methanoyl-2-oxidanyl-benzenesulfonic acid Openeye Name: 4-tert-butyl-3-formyl-2-hydroxy-benzenesulfonic acid CAS Name: 4-tert-butyl-3-formyl-2-hydroxybenzenesulfonic acid IUPAC Name: 4-tert-butyl-3-formyl-2-hydroxybenzenesulfonic acid Traditional Name: 4-tert-butyl-3-formyl-2-hydroxy-besylic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)S(=O)(=O)O)O)C=O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)S(=O)(=O)O)O)C=O

InChI

InChI=1S/C11H14O5S/c1-11(2,3)8-4-5-9(17(14,15)16)10(13)7(8)6-12/h4-6,13H,1-3H3,(H,14,15,16)