3,5-bis(3-chloranyl-4-fluoranyl-phenyl)-4-(2-hydroxyethyloxy)benzoic acid

Systemtic Name: 3,5-bis(3-chloranyl-4-fluoranyl-phenyl)-4-(2-hydroxyethyloxy)benzoic acid Openeye Name: 3,5-bis(3-chloro-4-fluoro-phenyl)-4-(2-hydroxyethoxy)benzoic acid CAS Name: 3,5-bis(3-chloro-4-fluorophenyl)-4-(2-hydroxyethoxy)benzoic acid IUPAC Name: 3,5-bis(3-chloro-4-fluorophenyl)-4-(2-hydroxyethoxy)benzoic acid Traditional Name: 3,5-bis(3-chloro-4-fluoro-phenyl)-4-(2-hydroxyethoxy)benzoic acid Formula: C21H14Cl2F2O4 MolecularWeight: 439.236266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=CC(=C2OCCO)C3=CC(=C(C=C3)F)Cl)C(=O)O)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1C2=CC(=CC(=C2OCCO)C3=CC(=C(C=C3)F)Cl)C(=O)O)Cl)F

InChI

InChI=1S/C21H14Cl2F2O4/c22-16-9-11(1-3-18(16)24)14-7-13(21(27)28)8-15(20(14)29-6-5-26)12-2-4-19(25)17(23)10-12/h1-4,7-10,26H,5-6H2,(H,27,28)