2-fluoranyl-4-[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid

Systemtic Name: 2-fluoranyl-4-[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid Openeye Name: 2-fluoro-4-[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indoline-6-carbonyl]amino]benzoic acid CAS Name: 2-fluoro-4-[[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydroindol-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-fluoro-4-[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydroindole-6-carbonyl]amino]benzoic acid Traditional Name: 2-fluoro-4-[[4-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indoline-6-carbonyl]amino]benzoic acid Formula: C24H18F4N2O6S MolecularWeight: 538.468133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1CCN2S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)NC4=CC(=C(C=C4)C(=O)O)F

Isomeric SMILES

COC1=CC(=CC2=C1CCN2S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)NC4=CC(=C(C=C4)C(=O)O)F

InChI

InChI=1S/C24H18F4N2O6S/c1-36-21-10-13(22(31)29-15-5-6-17(23(32)33)19(25)12-15)9-20-18(21)7-8-30(20)37(34,35)16-4-2-3-14(11-16)24(26,27)28/h2-6,9-12H,7-8H2,1H3,(H,29,31)(H,32,33)