1-(2-dodecylphenyl)-4,4,4-tris(fluoranyl)butane-1,3-dione

Systemtic Name: 1-(2-dodecylphenyl)-4,4,4-tris(fluoranyl)butane-1,3-dione Openeye Name: 1-(2-dodecylphenyl)-4,4,4-trifluoro-butane-1,3-dione CAS Name: 1-(2-dodecylphenyl)-4,4,4-trifluorobutane-1,3-dione IUPAC Name: 1-(2-dodecylphenyl)-4,4,4-trifluorobutane-1,3-dione Traditional Name: 4,4,4-trifluoro-1-(2-laurylphenyl)butane-1,3-dione Formula: C22H31F3O2 MolecularWeight: 384.47555

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1C(=O)CC(=O)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1C(=O)CC(=O)C(F)(F)F

InChI

InChI=1S/C22H31F3O2/c1-2-3-4-5-6-7-8-9-10-11-14-18-15-12-13-16-19(18)20(26)17-21(27)22(23,24)25/h12-13,15-16H,2-11,14,17H2,1H3