2-[[4-(4-fluoranyl-3-methyl-phenyl)-3-phenoxy-phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-(4-fluoranyl-3-methyl-phenyl)-3-phenoxy-phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-(4-fluoro-3-methyl-phenyl)-3-phenoxy-benzoyl]amino]benzoic acid CAS Name: 2-[[[4-(4-fluoro-3-methylphenyl)-3-phenoxyphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-(4-fluoro-3-methylphenyl)-3-phenoxybenzoyl]amino]benzoic acid Traditional Name: 2-[[4-(4-fluoro-3-methyl-phenyl)-3-phenoxy-benzoyl]amino]benzoic acid Formula: C27H20FNO4 MolecularWeight: 441.450403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)O)OC4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)O)OC4=CC=CC=C4)F

InChI

InChI=1S/C27H20FNO4/c1-17-15-18(12-14-23(17)28)21-13-11-19(16-25(21)33-20-7-3-2-4-8-20)26(30)29-24-10-6-5-9-22(24)27(31)32/h2-16H,1H3,(H,29,30)(H,31,32)