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

Systemtic Name: 3-[4-[[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-[[4-isopropyl-2-(trifluoromethyl)phenyl]sulfonylamino]-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-[[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylamino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-[[4-propan-2-yl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-[[4-isopropyl-2-(trifluoromethyl)phenyl]sulfonylamino]piperidino]sulfonylbenzoic acid Formula: C22H25F3N2O6S2 MolecularWeight: 534.56891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O)C(F)(F)F

InChI

InChI=1S/C22H25F3N2O6S2/c1-14(2)15-6-7-20(19(13-15)22(23,24)25)34(30,31)26-17-8-10-27(11-9-17)35(32,33)18-5-3-4-16(12-18)21(28)29/h3-7,12-14,17,26H,8-11H2,1-2H3,(H,28,29)