4-[4-[4-(1-methoxypropan-2-yloxysulfonyl)phenyl]hexan-2-yl]benzenesulfonic acid

Systemtic Name: 4-[4-[4-(1-methoxypropan-2-yloxysulfonyl)phenyl]hexan-2-yl]benzenesulfonic acid Openeye Name: 4-[3-[4-(2-methoxy-1-methyl-ethoxy)sulfonylphenyl]-1-methyl-pentyl]benzenesulfonic acid CAS Name: 4-[4-[4-(1-methoxypropan-2-yloxysulfonyl)phenyl]hexan-2-yl]benzenesulfonic acid IUPAC Name: 4-[4-[4-(1-methoxypropan-2-yloxysulfonyl)phenyl]hexan-2-yl]benzenesulfonic acid Traditional Name: 4-[3-[4-(2-methoxy-1-methyl-ethoxy)sulfonylphenyl]-1-methyl-pentyl]besylic acid Formula: C22H30O7S2 MolecularWeight: 470.5994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C1=CC=C(C=C1)S(=O)(=O)O)C2=CC=C(C=C2)S(=O)(=O)OC(C)COC

Isomeric SMILES

CCC(CC(C)C1=CC=C(C=C1)S(=O)(=O)O)C2=CC=C(C=C2)S(=O)(=O)OC(C)COC

InChI

InChI=1S/C22H30O7S2/c1-5-18(14-16(2)19-6-10-21(11-7-19)30(23,24)25)20-8-12-22(13-9-20)31(26,27)29-17(3)15-28-4/h6-13,16-18H,5,14-15H2,1-4H3,(H,23,24,25)