2-oxidanyl-5-(2,4,4-trimethylpentan-2-yl)benzene-1,3-disulfonic acid

Systemtic Name: 2-oxidanyl-5-(2,4,4-trimethylpentan-2-yl)benzene-1,3-disulfonic acid Openeye Name: 2-hydroxy-5-(1,1,3,3-tetramethylbutyl)benzene-1,3-disulfonic acid CAS Name: 2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)benzene-1,3-disulfonic acid IUPAC Name: 2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)benzene-1,3-disulfonic acid Traditional Name: 2-hydroxy-5-(1,1,3,3-tetramethylbutyl)benzene-1,3-disulfonic acid Formula: C14H22O7S2 MolecularWeight: 366.45028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O7S2/c1-13(2,3)8-14(4,5)9-6-10(22(16,17)18)12(15)11(7-9)23(19,20)21/h6-7,15H,8H2,1-5H3,(H,16,17,18)(H,19,20,21)