3-[4-[[4-pyridin-3-yl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-[[4-pyridin-3-yl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-[[4-(3-pyridyl)-2-(trifluoromethyl)phenyl]sulfonylamino]-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-[[4-(3-pyridinyl)-2-(trifluoromethyl)phenyl]sulfonylamino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-[[4-pyridin-3-yl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-[[4-(3-pyridyl)-2-(trifluoromethyl)phenyl]sulfonylamino]piperidino]sulfonylbenzoic acid Formula: C24H22F3N3O6S2 MolecularWeight: 569.57319

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=C(C=C(C=C2)C3=CN=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=C(C=C(C=C2)C3=CN=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C24H22F3N3O6S2/c25-24(26,27)21-14-16(18-4-2-10-28-15-18)6-7-22(21)37(33,34)29-19-8-11-30(12-9-19)38(35,36)20-5-1-3-17(13-20)23(31)32/h1-7,10,13-15,19,29H,8-9,11-12H2,(H,31,32)