2-(4-methylphenyl)-1-phenyl-1-benzothiophen-1-ium tetrafluoroborate

Systemtic Name: 2-(4-methylphenyl)-1-phenyl-1-benzothiophen-1-ium tetrafluoroborate Openeye Name: 1-phenyl-2-(p-tolyl)benzothiophen-1-ium tetrafluoroborate CAS Name: 2-(4-methylphenyl)-1-phenyl-1-benzothiophen-1-ium tetrafluoroborate IUPAC Name: 2-(4-methylphenyl)-1-phenyl-1-benzothiophen-1-ium tetrafluoroborate Traditional Name: 1-phenyl-2-(p-tolyl)benzothiophen-1-ium tetrafluoroborate Formula: C21H17BF4S MolecularWeight: 388.229293

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC=C(C=C1)C2=CC3=CC=CC=C3[S+]2C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC=C(C=C1)C2=CC3=CC=CC=C3[S+]2C4=CC=CC=C4

InChI

InChI=1S/C21H17S.BF4/c1-16-11-13-17(14-12-16)21-15-18-7-5-6-10-20(18)22(21)19-8-3-2-4-9-19;2-1(3,4)5/h2-15H,1H3;/q+1;-1