3-[3-[[5-(trifluoromethyl)pyridin-2-yl]sulfonylamino]phenyl]pentanoic acid

Systemtic Name: 3-[3-[[5-(trifluoromethyl)pyridin-2-yl]sulfonylamino]phenyl]pentanoic acid Openeye Name: 3-[3-[[5-(trifluoromethyl)-2-pyridyl]sulfonylamino]phenyl]pentanoic acid CAS Name: 3-[3-[[5-(trifluoromethyl)-2-pyridinyl]sulfonylamino]phenyl]pentanoic acid IUPAC Name: 3-[3-[[5-(trifluoromethyl)pyridin-2-yl]sulfonylamino]phenyl]pentanoic acid Traditional Name: 3-[3-[[5-(trifluoromethyl)-2-pyridyl]sulfonylamino]phenyl]valeric acid Formula: C17H17F3N2O4S MolecularWeight: 402.38809

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)C1=CC(=CC=C1)NS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCC(CC(=O)O)C1=CC(=CC=C1)NS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O4S/c1-2-11(9-16(23)24)12-4-3-5-14(8-12)22-27(25,26)15-7-6-13(10-21-15)17(18,19)20/h3-8,10-11,22H,2,9H2,1H3,(H,23,24)