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

Systemtic Name: 2-(3-butyl-4-pyridin-3-yl-phenoxy)-2-[(4-chlorophenyl)sulfonylamino]ethanoic acid Openeye Name: 2-[3-butyl-4-(3-pyridyl)phenoxy]-2-[(4-chlorophenyl)sulfonylamino]acetic acid CAS Name: 2-[3-butyl-4-(3-pyridinyl)phenoxy]-2-[(4-chlorophenyl)sulfonylamino]acetic acid IUPAC Name: 2-(3-butyl-4-pyridin-3-ylphenoxy)-2-[(4-chlorophenyl)sulfonylamino]acetic acid Traditional Name: 2-[3-butyl-4-(3-pyridyl)phenoxy]-2-[(4-chlorophenyl)sulfonylamino]acetic acid Formula: C23H23ClN2O5S MolecularWeight: 474.95712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)OC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CN=CC=C3

Isomeric SMILES

CCCCC1=C(C=CC(=C1)OC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CN=CC=C3

InChI

InChI=1S/C23H23ClN2O5S/c1-2-3-5-16-14-19(9-12-21(16)17-6-4-13-25-15-17)31-22(23(27)28)26-32(29,30)20-10-7-18(24)8-11-20/h4,6-15,22,26H,2-3,5H2,1H3,(H,27,28)