1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-methoxy-6-oxidanyl-phenyl)propane-1,3-dione

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-methoxy-6-oxidanyl-phenyl)propane-1,3-dione Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-hydroxy-6-methoxy-phenyl)propane-1,3-dione CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-hydroxy-6-methoxyphenyl)propane-1,3-dione IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-hydroxy-6-methoxyphenyl)propane-1,3-dione Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-hydroxy-6-methoxy-phenyl)propane-1,3-dione Formula: C18H12F6O4 MolecularWeight: 406.275899

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C(=O)CC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O

Isomeric SMILES

COC1=CC=CC(=C1C(=O)CC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O

InChI

InChI=1S/C18H12F6O4/c1-28-15-4-2-3-12(25)16(15)14(27)8-13(26)9-5-10(17(19,20)21)7-11(6-9)18(22,23)24/h2-7,25H,8H2,1H3