bis(4-tert-butylphenyl)-(4-methoxy-3-methoxycarbonyl-4-oxidanylidene-2-phenyl-but-2-enyl)sulfanium; ethenyl-tris(4-fluorophenyl)boranuide

Systemtic Name: bis(4-tert-butylphenyl)-(4-methoxy-3-methoxycarbonyl-4-oxidanylidene-2-phenyl-but-2-enyl)sulfanium; ethenyl-tris(4-fluorophenyl)boranuide Openeye Name: bis(4-tert-butylphenyl)-(4-methoxy-3-methoxycarbonyl-4-oxo-2-phenyl-but-2-enyl)sulfonium; tris(4-fluorophenyl)-vinyl-boranuide CAS Name: bis(4-tert-butylphenyl)-(4-methoxy-3-methoxycarbonyl-4-oxo-2-phenylbut-2-enyl)sulfonium; ethenyl-tris(4-fluorophenyl)boranuide IUPAC Name: bis(4-tert-butylphenyl)-(4-methoxy-3-methoxycarbonyl-4-oxo-2-phenylbut-2-enyl)sulfanium; ethenyl-tris(4-fluorophenyl)boranuide Traditional Name: bis(4-tert-butylphenyl)-(3-carbomethoxy-4-keto-4-methoxy-2-phenyl-but-2-enyl)sulfonium; tris(4-fluorophenyl)-vinyl-boranuide Formula: C53H54BF3O4S MolecularWeight: 854.86467

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C=C)(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.CC(C)(C)C1=CC=C(C=C1)[S+](CC(=C(C(=O)OC)C(=O)OC)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

[B-](C=C)(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.CC(C)(C)C1=CC=C(C=C1)[S+](CC(=C(C(=O)OC)C(=O)OC)C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C33H39O4S.C20H15BF3/c1-32(2,3)24-14-18-26(19-15-24)38(27-20-16-25(17-21-27)33(4,5)6)22-28(23-12-10-9-11-13-23)29(30(34)36-7)31(35)37-8;1-2-21(15-3-9-18(22)10-4-15,16-5-11-19(23)12-6-16)17-7-13-20(24)14-8-17/h9-21H,22H2,1-8H3;2-14H,1H2/q+1;-1