2-methyl-2-[4-[2-[(4-methylphenyl)sulfonylamino]propyl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-[2-[(4-methylphenyl)sulfonylamino]propyl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-[2-(p-tolylsulfonylamino)propyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[2-[(4-methylphenyl)sulfonylamino]propyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-[2-[(4-methylphenyl)sulfonylamino]propyl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-[2-(tosylamino)propyl]phenoxy]propionic acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)CC2=CC=C(C=C2)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)CC2=CC=C(C=C2)OC(C)(C)C(=O)O

InChI

InChI=1S/C20H25NO5S/c1-14-5-11-18(12-6-14)27(24,25)21-15(2)13-16-7-9-17(10-8-16)26-20(3,4)19(22)23/h5-12,15,21H,13H2,1-4H3,(H,22,23)