2-[[2-fluoranyl-4-(4-phenoxyphenyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid

Systemtic Name: 2-[[2-fluoranyl-4-(4-phenoxyphenyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Openeye Name: 2-[[2-fluoro-4-(4-phenoxyphenyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid CAS Name: 2-[[2-fluoro-4-(4-phenoxyphenyl)anilino]-oxomethyl]-1-cyclopentenecarboxylic acid IUPAC Name: 2-[[2-fluoro-4-(4-phenoxyphenyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Traditional Name: 2-[[2-fluoro-4-(4-phenoxyphenyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Formula: C25H20FNO4 MolecularWeight: 417.429003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C(=O)O)C(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)OC4=CC=CC=C4)F

Isomeric SMILES

C1CC(=C(C1)C(=O)O)C(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)OC4=CC=CC=C4)F

InChI

InChI=1S/C25H20FNO4/c26-22-15-17(16-9-12-19(13-10-16)31-18-5-2-1-3-6-18)11-14-23(22)27-24(28)20-7-4-8-21(20)25(29)30/h1-3,5-6,9-15H,4,7-8H2,(H,27,28)(H,29,30)