3-tert-butyl-2-oxidanyl-5-(phenylcarbonyloxy)benzenesulfonic acid

Systemtic Name: 3-tert-butyl-2-oxidanyl-5-(phenylcarbonyloxy)benzenesulfonic acid Openeye Name: 5-benzoyloxy-3-tert-butyl-2-hydroxy-benzenesulfonic acid CAS Name: 5-benzoyloxy-3-tert-butyl-2-hydroxybenzenesulfonic acid IUPAC Name: 5-benzoyloxy-3-tert-butyl-2-hydroxybenzenesulfonic acid Traditional Name: 5-benzoyloxy-3-tert-butyl-2-hydroxy-besylic acid Formula: C17H18O6S MolecularWeight: 350.38622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)S(=O)(=O)O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)S(=O)(=O)O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18O6S/c1-17(2,3)13-9-12(10-14(15(13)18)24(20,21)22)23-16(19)11-7-5-4-6-8-11/h4-10,18H,1-3H3,(H,20,21,22)