(3-methyl-2-oxidanyl-5-pentyl-phenyl) 3-methyl-2-oxidanyl-5-pentyl-benzenesulfinate

Systemtic Name: (3-methyl-2-oxidanyl-5-pentyl-phenyl) 3-methyl-2-oxidanyl-5-pentyl-benzenesulfinate Openeye Name: (2-hydroxy-3-methyl-5-pentyl-phenyl) 2-hydroxy-3-methyl-5-pentyl-benzenesulfinate CAS Name: 2-hydroxy-3-methyl-5-pentylbenzenesulfinic acid (2-hydroxy-3-methyl-5-pentylphenyl) ester IUPAC Name: (2-hydroxy-3-methyl-5-pentylphenyl) 2-hydroxy-3-methyl-5-pentylbenzenesulfinate Traditional Name: 5-amyl-2-hydroxy-3-methyl-benzenesulfinic acid (5-amyl-2-hydroxy-3-methyl-phenyl) ester Formula: C24H34O4S MolecularWeight: 418.58936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)OS(=O)C2=CC(=CC(=C2O)C)CCCCC)O)C

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)OS(=O)C2=CC(=CC(=C2O)C)CCCCC)O)C

InChI

InChI=1S/C24H34O4S/c1-5-7-9-11-19-13-17(3)23(25)21(15-19)28-29(27)22-16-20(12-10-8-6-2)14-18(4)24(22)26/h13-16,25-26H,5-12H2,1-4H3