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

Systemtic Name: 2-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yl-ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridyl)ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridinyl)ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-ylethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridyl)ethyl]phenoxy]acetic acid Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O5S/c22-17-5-9-19(10-6-17)30(27,28)24-13-20(16-2-1-11-23-12-16)15-3-7-18(8-4-15)29-14-21(25)26/h1-12,20,24H,13-14H2,(H,25,26)