2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonylamino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[(4-tert-butylphenyl)methyl-methylsulfonylamino]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[[(4-tert-butylbenzyl)-mesyl-amino]methyl]phenoxy]acetic acid Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=CC=C2)OCC(=O)O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=CC=C2)OCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C21H27NO5S/c1-21(2,3)18-10-8-16(9-11-18)13-22(28(4,25)26)14-17-6-5-7-19(12-17)27-15-20(23)24/h5-12H,13-15H2,1-4H3,(H,23,24)