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

Systemtic Name: 5-decyl-2-oxidanyl-3-(2-phenylpropan-2-yl)benzenesulfonic acid Openeye Name: 5-decyl-2-hydroxy-3-(1-methyl-1-phenyl-ethyl)benzenesulfonic acid CAS Name: 5-decyl-2-hydroxy-3-(2-phenylpropan-2-yl)benzenesulfonic acid IUPAC Name: 5-decyl-2-hydroxy-3-(2-phenylpropan-2-yl)benzenesulfonic acid Traditional Name: 3-cumyl-5-decyl-2-hydroxy-besylic acid Formula: C25H36O4S MolecularWeight: 432.61594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C25H36O4S/c1-4-5-6-7-8-9-10-12-15-20-18-22(24(26)23(19-20)30(27,28)29)25(2,3)21-16-13-11-14-17-21/h11,13-14,16-19,26H,4-10,12,15H2,1-3H3,(H,27,28,29)