2-[4-[(5-tert-butyl-2-methyl-phenyl)sulfonyl-methyl-amino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(5-tert-butyl-2-methyl-phenyl)sulfonyl-methyl-amino]phenoxy]ethanoic acid Openeye Name: 2-[4-[(5-tert-butyl-2-methyl-phenyl)sulfonyl-methyl-amino]phenoxy]acetic acid CAS Name: 2-[4-[(5-tert-butyl-2-methylphenyl)sulfonyl-methylamino]phenoxy]acetic acid IUPAC Name: 2-[4-[(5-tert-butyl-2-methylphenyl)sulfonyl-methylamino]phenoxy]acetic acid Traditional Name: 2-[4-[(5-tert-butyl-2-methyl-phenyl)sulfonyl-methyl-amino]phenoxy]acetic acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C20H25NO5S/c1-14-6-7-15(20(2,3)4)12-18(14)27(24,25)21(5)16-8-10-17(11-9-16)26-13-19(22)23/h6-12H,13H2,1-5H3,(H,22,23)