2,2-bis-(4-methylphenyl)sulfonyloxyethanoic acid

Systemtic Name: 2,2-bis-(4-methylphenyl)sulfonyloxyethanoic acid Openeye Name: 2,2-bis(p-tolylsulfonyloxy)acetic acid CAS Name: 2,2-bis-(4-methylphenyl)sulfonyloxyacetic acid IUPAC Name: 2,2-bis-(4-methylphenyl)sulfonyloxyacetic acid Traditional Name: 2,2-ditosyloxyacetic acid Formula: C16H16O8S2 MolecularWeight: 400.42344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C(=O)O)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C(=O)O)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H16O8S2/c1-11-3-7-13(8-4-11)25(19,20)23-16(15(17)18)24-26(21,22)14-9-5-12(2)6-10-14/h3-10,16H,1-2H3,(H,17,18)