2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yl-propyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yl-propyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridyl)propyl]phenoxy]acetic acid CAS Name: 2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridinyl)propyl]phenoxy]acetic acid IUPAC Name: 2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-ylpropyl]phenoxy]acetic acid Traditional Name: 2-[4-[3-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridyl)propyl]phenoxy]acetic acid Formula: C22H21ClN2O5S MolecularWeight: 460.93054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CCNS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C(CCNS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OCC(=O)O

InChI

InChI=1S/C22H21ClN2O5S/c23-18-5-9-20(10-6-18)31(28,29)25-13-11-21(17-2-1-12-24-14-17)16-3-7-19(8-4-16)30-15-22(26)27/h1-10,12,14,21,25H,11,13,15H2,(H,26,27)