4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid

Systemtic Name: 4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid Openeye Name: 4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid CAS Name: 4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid IUPAC Name: 4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid Traditional Name: 4-phenoxy-3,6-bis(trifluoromethyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboxylic acid Formula: C18H10F6O9 MolecularWeight: 484.257019

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(C(C(=C2)C(F)(F)F)(C(=O)O)C(=O)O)(C(=O)O)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(C(C(=C2)C(F)(F)F)(C(=O)O)C(=O)O)(C(=O)O)C(=O)O)C(F)(F)F

InChI

InChI=1S/C18H10F6O9/c19-17(20,21)9-6-8(33-7-4-2-1-3-5-7)10(18(22,23)24)16(13(29)30,14(31)32)15(9,11(25)26)12(27)28/h1-6H,(H,25,26)(H,27,28)(H,29,30)(H,31,32)