[1-anthracen-9-yl-2,2,2-tris(fluoranyl)ethyl] 3,3-dimethyl-2-phenylselanyl-butanoate

Systemtic Name: [1-anthracen-9-yl-2,2,2-tris(fluoranyl)ethyl] 3,3-dimethyl-2-phenylselanyl-butanoate Openeye Name: [1-(9-anthryl)-2,2,2-trifluoro-ethyl] 3,3-dimethyl-2-phenylselanyl-butanoate CAS Name: 3,3-dimethyl-2-(phenylseleno)butanoic acid [1-(9-anthracenyl)-2,2,2-trifluoroethyl] ester IUPAC Name: (1-anthracen-9-yl-2,2,2-trifluoroethyl) 3,3-dimethyl-2-phenylselanylbutanoate Traditional Name: 3,3-dimethyl-2-(phenylseleno)butyric acid [1-(9-anthryl)-2,2,2-trifluoro-ethyl] ester Formula: C28H25F3O2Se MolecularWeight: 529.45211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)OC(C1=C2C=CC=CC2=CC3=CC=CC=C31)C(F)(F)F)[Se]C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(C(=O)OC(C1=C2C=CC=CC2=CC3=CC=CC=C31)C(F)(F)F)[Se]C4=CC=CC=C4

InChI

InChI=1S/C28H25F3O2Se/c1-27(2,3)25(34-20-13-5-4-6-14-20)26(32)33-24(28(29,30)31)23-21-15-9-7-11-18(21)17-19-12-8-10-16-22(19)23/h4-17,24-25H,1-3H3