4-oxidanyl-5-(phenylcarbonyl)-2-propan-2-yloxy-benzenesulfonic acid

Systemtic Name: 4-oxidanyl-5-(phenylcarbonyl)-2-propan-2-yloxy-benzenesulfonic acid Openeye Name: 5-benzoyl-4-hydroxy-2-isopropoxy-benzenesulfonic acid CAS Name: 5-benzoyl-4-hydroxy-2-propan-2-yloxybenzenesulfonic acid IUPAC Name: 5-benzoyl-4-hydroxy-2-propan-2-yloxybenzenesulfonic acid Traditional Name: 5-benzoyl-4-hydroxy-2-isopropoxy-besylic acid Formula: C16H16O6S MolecularWeight: 336.35964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C16H16O6S/c1-10(2)22-14-9-13(17)12(8-15(14)23(19,20)21)16(18)11-6-4-3-5-7-11/h3-10,17H,1-2H3,(H,19,20,21)