2,4,6-tris(3-bicyclo[2.2.1]heptanylmethoxycarbonyl)benzenesulfonic acid

Systemtic Name: 2,4,6-tris(3-bicyclo[2.2.1]heptanylmethoxycarbonyl)benzenesulfonic acid Openeye Name: 2,4,6-tris(norbornan-2-ylmethoxycarbonyl)benzenesulfonic acid CAS Name: 2,4,6-tris[3-bicyclo[2.2.1]heptanylmethoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 2,4,6-tris(3-bicyclo[2.2.1]heptanylmethoxycarbonyl)benzenesulfonic acid Traditional Name: 2,4,6-tris(2-norbornylmethoxycarbonyl)besylic acid Formula: C33H42O9S MolecularWeight: 614.74618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2COC(=O)C3=CC(=C(C(=C3)C(=O)OCC4CC5CCC4C5)S(=O)(=O)O)C(=O)OCC6CC7CCC6C7

Isomeric SMILES

C1CC2CC1CC2COC(=O)C3=CC(=C(C(=C3)C(=O)OCC4CC5CCC4C5)S(=O)(=O)O)C(=O)OCC6CC7CCC6C7

InChI

InChI=1S/C33H42O9S/c34-31(40-15-25-10-18-1-4-21(25)7-18)24-13-28(32(35)41-16-26-11-19-2-5-22(26)8-19)30(43(37,38)39)29(14-24)33(36)42-17-27-12-20-3-6-23(27)9-20/h13-14,18-23,25-27H,1-12,15-17H2,(H,37,38,39)