2-[3-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxyphenyl]ethanoic acid

Systemtic Name: 2-[3-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxyphenyl]ethanoic acid Openeye Name: 2-[3-(2,4,6-triisopropylphenyl)sulfonyloxyphenyl]acetic acid CAS Name: 2-[3-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxyphenyl]acetic acid IUPAC Name: 2-[3-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxyphenyl]acetic acid Traditional Name: 2-[3-(2,4,6-triisopropylphenyl)sulfonyloxyphenyl]acetic acid Formula: C23H30O5S MolecularWeight: 418.5463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC2=CC=CC(=C2)CC(=O)O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC2=CC=CC(=C2)CC(=O)O)C(C)C

InChI

InChI=1S/C23H30O5S/c1-14(2)18-12-20(15(3)4)23(21(13-18)16(5)6)29(26,27)28-19-9-7-8-17(10-19)11-22(24)25/h7-10,12-16H,11H2,1-6H3,(H,24,25)