2-oxidanyl-5-(phenylmethyl)-3-(2-phenylpropan-2-yl)benzenesulfonic acid

Systemtic Name: 2-oxidanyl-5-(phenylmethyl)-3-(2-phenylpropan-2-yl)benzenesulfonic acid Openeye Name: 5-benzyl-2-hydroxy-3-(1-methyl-1-phenyl-ethyl)benzenesulfonic acid CAS Name: 2-hydroxy-5-(phenylmethyl)-3-(2-phenylpropan-2-yl)benzenesulfonic acid IUPAC Name: 5-benzyl-2-hydroxy-3-(2-phenylpropan-2-yl)benzenesulfonic acid Traditional Name: 5-benzyl-3-cumyl-2-hydroxy-besylic acid Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=C(C(=CC(=C2)CC3=CC=CC=C3)S(=O)(=O)O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=C(C(=CC(=C2)CC3=CC=CC=C3)S(=O)(=O)O)O

InChI

InChI=1S/C22H22O4S/c1-22(2,18-11-7-4-8-12-18)19-14-17(13-16-9-5-3-6-10-16)15-20(21(19)23)27(24,25)26/h3-12,14-15,23H,13H2,1-2H3,(H,24,25,26)