6-(3-bromanyl-4-chloranyl-phenyl)-5-[4-(trifluoromethylsulfonyl)phenyl]spiro[2.4]hepta-4,6-diene

Systemtic Name: 6-(3-bromanyl-4-chloranyl-phenyl)-5-[4-(trifluoromethylsulfonyl)phenyl]spiro[2.4]hepta-4,6-diene Openeye Name: 6-(3-bromo-4-chloro-phenyl)-5-[4-(trifluoromethylsulfonyl)phenyl]spiro[2.4]hepta-4,6-diene CAS Name: 6-(3-bromo-4-chlorophenyl)-5-[4-(trifluoromethylsulfonyl)phenyl]spiro[2.4]hepta-4,6-diene IUPAC Name: 6-(3-bromo-4-chlorophenyl)-5-[4-(trifluoromethylsulfonyl)phenyl]spiro[2.4]hepta-4,6-diene Traditional Name: 6-(3-bromo-4-chloro-phenyl)-5-(4-triflylphenyl)spiro[2.4]hepta-4,6-diene Formula: C20H13BrClF3O2S MolecularWeight: 489.73323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC12C=C(C(=C2)C3=CC(=C(C=C3)Cl)Br)C4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1CC12C=C(C(=C2)C3=CC(=C(C=C3)Cl)Br)C4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C20H13BrClF3O2S/c21-17-9-13(3-6-18(17)22)16-11-19(7-8-19)10-15(16)12-1-4-14(5-2-12)28(26,27)20(23,24)25/h1-6,9-11H,7-8H2