4-fluoranylbenzenesulfonate; tris(4-dimethylaminophenyl)sulfanium

Systemtic Name: 4-fluoranylbenzenesulfonate; tris(4-dimethylaminophenyl)sulfanium Openeye Name: 4-fluorobenzenesulfonate; tris(4-dimethylaminophenyl)sulfonium CAS Name: 4-fluorobenzenesulfonate; tris(4-dimethylaminophenyl)sulfonium IUPAC Name: 4-fluorobenzenesulfonate; tris(4-dimethylaminophenyl)sulfanium Traditional Name: 4-fluorobesylate; tris(4-dimethylaminophenyl)sulfonium Formula: C30H34FN3O3S2 MolecularWeight: 567.737663

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)[S+](C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.C1=CC(=CC=C1F)S(=O)(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[S+](C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.C1=CC(=CC=C1F)S(=O)(=O)[O-]

InChI

InChI=1S/C24H30N3S.C6H5FO3S/c1-25(2)19-7-13-22(14-8-19)28(23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6;7-5-1-3-6(4-2-5)11(8,9)10/h7-18H,1-6H3;1-4H,(H,8,9,10)/q+1;/p-1