2-[[4-(3-ethanoylphenyl)-2-fluoranyl-phenyl]carbamoyl]cyclopentene-1-carboxylic acid

Systemtic Name: 2-[[4-(3-ethanoylphenyl)-2-fluoranyl-phenyl]carbamoyl]cyclopentene-1-carboxylic acid Openeye Name: 2-[[4-(3-acetylphenyl)-2-fluoro-phenyl]carbamoyl]cyclopentene-1-carboxylic acid CAS Name: 2-[[4-(3-acetylphenyl)-2-fluoroanilino]-oxomethyl]-1-cyclopentenecarboxylic acid IUPAC Name: 2-[[4-(3-acetylphenyl)-2-fluorophenyl]carbamoyl]cyclopentene-1-carboxylic acid Traditional Name: 2-[[4-(3-acetylphenyl)-2-fluoro-phenyl]carbamoyl]cyclopentene-1-carboxylic acid Formula: C21H18FNO4 MolecularWeight: 367.370323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3)C(=O)O)F

Isomeric SMILES

CC(=O)C1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3)C(=O)O)F

InChI

InChI=1S/C21H18FNO4/c1-12(24)13-4-2-5-14(10-13)15-8-9-19(18(22)11-15)23-20(25)16-6-3-7-17(16)21(26)27/h2,4-5,8-11H,3,6-7H2,1H3,(H,23,25)(H,26,27)