3-[(2,3-dicarboxy-6-fluoranyl-phenyl)methyl]-4-fluoranyl-phthalic acid

Systemtic Name: 3-[(2,3-dicarboxy-6-fluoranyl-phenyl)methyl]-4-fluoranyl-phthalic acid Openeye Name: 3-[(2,3-dicarboxy-6-fluoro-phenyl)methyl]-4-fluoro-phthalic acid CAS Name: 3-[(2,3-dicarboxy-6-fluorophenyl)methyl]-4-fluorophthalic acid IUPAC Name: 3-[(2,3-dicarboxy-6-fluorophenyl)methyl]-4-fluorophthalic acid Traditional Name: 3-(2,3-dicarboxy-6-fluoro-benzyl)-4-fluoro-phthalic acid Formula: C17H10F2O8 MolecularWeight: 380.253306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C(=O)O)C(=O)O)CC2=C(C=CC(=C2C(=O)O)C(=O)O)F)F

Isomeric SMILES

C1=CC(=C(C(=C1C(=O)O)C(=O)O)CC2=C(C=CC(=C2C(=O)O)C(=O)O)F)F

InChI

InChI=1S/C17H10F2O8/c18-10-3-1-6(14(20)21)12(16(24)25)8(10)5-9-11(19)4-2-7(15(22)23)13(9)17(26)27/h1-4H,5H2,(H,20,21)(H,22,23)(H,24,25)(H,26,27)