2-chloranyl-4-[[1-(3-fluorophenyl)sulfonyl-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid

Systemtic Name: 2-chloranyl-4-[[1-(3-fluorophenyl)sulfonyl-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid Openeye Name: 2-chloro-4-[[1-(3-fluorophenyl)sulfonylindoline-6-carbonyl]amino]benzoic acid CAS Name: 2-chloro-4-[[[1-(3-fluorophenyl)sulfonyl-2,3-dihydroindol-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-chloro-4-[[1-(3-fluorophenyl)sulfonyl-2,3-dihydroindole-6-carbonyl]amino]benzoic acid Traditional Name: 2-chloro-4-[[1-(3-fluorophenyl)sulfonylindoline-6-carbonyl]amino]benzoic acid Formula: C22H16ClFN2O5S MolecularWeight: 474.889243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C(=O)O)Cl)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(C2=C1C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C(=O)O)Cl)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C22H16ClFN2O5S/c23-19-12-16(6-7-18(19)22(28)29)25-21(27)14-5-4-13-8-9-26(20(13)10-14)32(30,31)17-3-1-2-15(24)11-17/h1-7,10-12H,8-9H2,(H,25,27)(H,28,29)