2-acetyloxybenzoic acid; 5-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-benzoic acid

Systemtic Name: 2-acetyloxybenzoic acid; 5-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-benzoic acid Openeye Name: 2-acetoxybenzoic acid; 5-(2,4-difluorophenyl)-2-hydroxy-benzoic acid CAS Name: 2-acetyloxybenzoic acid; 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid IUPAC Name: 2-acetyloxybenzoic acid; 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid Traditional Name: 2-acetoxybenzoic acid; 5-(2,4-difluorophenyl)-2-hydroxy-benzoic acid Formula: C22H16F2O7 MolecularWeight: 430.355046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O.C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O.C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O

InChI

InChI=1S/C13H8F2O3.C9H8O4/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18;1-6(10)13-8-5-3-2-4-7(8)9(11)12/h1-6,16H,(H,17,18);2-5H,1H3,(H,11,12)