3,5-bis(4-methylpentan-2-yloxycarbonyl)benzenesulfonic acid

Systemtic Name: 3,5-bis(4-methylpentan-2-yloxycarbonyl)benzenesulfonic acid Openeye Name: 3,5-bis(1,3-dimethylbutoxycarbonyl)benzenesulfonic acid CAS Name: 3,5-bis[4-methylpentan-2-yloxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 3,5-bis(4-methylpentan-2-yloxycarbonyl)benzenesulfonic acid Traditional Name: 3,5-bis(1,3-dimethylbutoxycarbonyl)besylic acid Formula: C20H30O7S MolecularWeight: 414.513

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OC(C)CC(C)C

Isomeric SMILES

CC(C)CC(C)OC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OC(C)CC(C)C

InChI

InChI=1S/C20H30O7S/c1-12(2)7-14(5)26-19(21)16-9-17(11-18(10-16)28(23,24)25)20(22)27-15(6)8-13(3)4/h9-15H,7-8H2,1-6H3,(H,23,24,25)