1-bromanyl-4-[(2S)-1-fluoranyl-1,1-bis(phenylsulfonyl)but-3-en-2-yl]benzene

Systemtic Name: 1-bromanyl-4-[(2S)-1-fluoranyl-1,1-bis(phenylsulfonyl)but-3-en-2-yl]benzene Openeye Name: 1-[(1S)-1-[bis(benzenesulfonyl)-fluoro-methyl]allyl]-4-bromo-benzene CAS Name: 1-[(2S)-1,1-bis(benzenesulfonyl)-1-fluorobut-3-en-2-yl]-4-bromobenzene IUPAC Name: 1-[(2S)-1,1-bis(benzenesulfonyl)-1-fluorobut-3-en-2-yl]-4-bromobenzene Traditional Name: 1-bromo-4-[(1S)-1-[dibesyl(fluoro)methyl]allyl]benzene Formula: C22H18BrFO4S2 MolecularWeight: 509.408323

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1=CC=C(C=C1)Br)C(F)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C=C[C@@H](C1=CC=C(C=C1)Br)C(F)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18BrFO4S2/c1-2-21(17-13-15-18(23)16-14-17)22(24,29(25,26)19-9-5-3-6-10-19)30(27,28)20-11-7-4-8-12-20/h2-16,21H,1H2/t21-/m0/s1