2-(1,3-diphenylprop-2-ynylidene)-1,3-dihydroisoindol-2-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-(1,3-diphenylprop-2-ynylidene)-1,3-dihydroisoindol-2-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2-(1,3-diphenylprop-2-ynylidene)isoindolin-2-ium; trifluoromethanesulfonate CAS Name: 2-(1,3-diphenylprop-2-ynylidene)-1,3-dihydroisoindol-2-ium; trifluoromethanesulfonate IUPAC Name: 2-(1,3-diphenylprop-2-ynylidene)-1,3-dihydroisoindol-2-ium; trifluoromethanesulfonate Traditional Name: 2-(1,3-diphenylprop-2-ynylidene)isoindolin-2-ium triflate Formula: C24H18F3NO3S MolecularWeight: 457.46483

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C[N+]1=C(C#CC3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C[N+]1=C(C#CC3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C23H18N.CHF3O3S/c1-3-9-19(10-4-1)15-16-23(20-11-5-2-6-12-20)24-17-21-13-7-8-14-22(21)18-24;2-1(3,4)8(5,6)7/h1-14H,17-18H2;(H,5,6,7)/q+1;/p-1