5-tert-butyl-3-(1,3-diphenylbutyl)-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 5-tert-butyl-3-(1,3-diphenylbutyl)-2-oxidanyl-benzenesulfonic acid Openeye Name: 5-tert-butyl-3-(1,3-diphenylbutyl)-2-hydroxy-benzenesulfonic acid CAS Name: 5-tert-butyl-3-(1,3-diphenylbutyl)-2-hydroxybenzenesulfonic acid IUPAC Name: 5-tert-butyl-3-(1,3-diphenylbutyl)-2-hydroxybenzenesulfonic acid Traditional Name: 5-tert-butyl-3-(1,3-diphenylbutyl)-2-hydroxy-besylic acid Formula: C26H30O4S MolecularWeight: 438.579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30O4S/c1-18(19-11-7-5-8-12-19)15-22(20-13-9-6-10-14-20)23-16-21(26(2,3)4)17-24(25(23)27)31(28,29)30/h5-14,16-18,22,27H,15H2,1-4H3,(H,28,29,30)