2-[4-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]ethanoic acid

Systemtic Name: 2-[4-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]ethanoic acid Openeye Name: 2-[4-[3,4-bis(p-tolylsulfonylamino)phenoxy]phenyl]acetic acid CAS Name: 2-[4-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]acetic acid IUPAC Name: 2-[4-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]acetic acid Traditional Name: 2-[4-[3,4-bis(tosylamino)phenoxy]phenyl]acetic acid Formula: C28H26N2O7S2 MolecularWeight: 566.64524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)OC3=CC=C(C=C3)CC(=O)O)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)OC3=CC=C(C=C3)CC(=O)O)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H26N2O7S2/c1-19-3-12-24(13-4-19)38(33,34)29-26-16-11-23(37-22-9-7-21(8-10-22)17-28(31)32)18-27(26)30-39(35,36)25-14-5-20(2)6-15-25/h3-16,18,29-30H,17H2,1-2H3,(H,31,32)