dodecyl 3,4,5-tris(methylsulfonyloxy)benzoate

Systemtic Name: dodecyl 3,4,5-tris(methylsulfonyloxy)benzoate Openeye Name: dodecyl 3,4,5-tris(methylsulfonyloxy)benzoate CAS Name: 3,4,5-tris(methylsulfonyloxy)benzoic acid dodecyl ester IUPAC Name: dodecyl 3,4,5-tris(methylsulfonyloxy)benzoate Traditional Name: 3,4,5-tris(methylsulfonyloxy)benzoic acid lauryl ester Formula: C22H36O11S3 MolecularWeight: 572.70964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C22H36O11S3/c1-5-6-7-8-9-10-11-12-13-14-15-30-22(23)18-16-19(31-34(2,24)25)21(33-36(4,28)29)20(17-18)32-35(3,26)27/h16-17H,5-15H2,1-4H3