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

Systemtic Name: 2-[3-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]ethanoic acid Openeye Name: 2-[3-[3,4-bis(p-tolylsulfonylamino)phenoxy]phenyl]acetic acid CAS Name: 2-[3-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]acetic acid IUPAC Name: 2-[3-[3,4-bis[(4-methylphenyl)sulfonylamino]phenoxy]phenyl]acetic acid Traditional Name: 2-[3-[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=CC(=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=CC(=C3)CC(=O)O)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

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