4-[2-(4,4-disulfocyclohexyl)propan-2-yl]cyclohexane-1,1-disulfonic acid

Systemtic Name: 4-[2-(4,4-disulfocyclohexyl)propan-2-yl]cyclohexane-1,1-disulfonic acid Openeye Name: 4-[1-(4,4-disulfocyclohexyl)-1-methyl-ethyl]cyclohexane-1,1-disulfonic acid CAS Name: 4-[2-(4,4-disulfocyclohexyl)propan-2-yl]cyclohexane-1,1-disulfonic acid IUPAC Name: 4-[2-(4,4-disulfocyclohexyl)propan-2-yl]cyclohexane-1,1-disulfonic acid Traditional Name: 4-[1-(4,4-disulfocyclohexyl)-1-methyl-ethyl]cyclohexane-1,1-disulfonic acid Formula: C15H28O12S4 MolecularWeight: 528.63562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCC(CC1)(S(=O)(=O)O)S(=O)(=O)O)C2CCC(CC2)(S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(C)(C1CCC(CC1)(S(=O)(=O)O)S(=O)(=O)O)C2CCC(CC2)(S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C15H28O12S4/c1-13(2,11-3-7-14(8-4-11,28(16,17)18)29(19,20)21)12-5-9-15(10-6-12,30(22,23)24)31(25,26)27/h11-12H,3-10H2,1-2H3,(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)