2-(5-decyl-2-oxidanyl-phenyl)benzenesulfonic acid

Systemtic Name: 2-(5-decyl-2-oxidanyl-phenyl)benzenesulfonic acid Openeye Name: 2-(5-decyl-2-hydroxy-phenyl)benzenesulfonic acid CAS Name: 2-(5-decyl-2-hydroxyphenyl)benzenesulfonic acid IUPAC Name: 2-(5-decyl-2-hydroxyphenyl)benzenesulfonic acid Traditional Name: 2-(5-decyl-2-hydroxy-phenyl)besylic acid Formula: C22H30O4S MolecularWeight: 390.5362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)O)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)O)C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C22H30O4S/c1-2-3-4-5-6-7-8-9-12-18-15-16-21(23)20(17-18)19-13-10-11-14-22(19)27(24,25)26/h10-11,13-17,23H,2-9,12H2,1H3,(H,24,25,26)