1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium

Systemtic Name: 1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-(1,3-diphenylprop-2-ynylidene)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C26H22F3N2+ MolecularWeight: 419.46149

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(C#CC2=CC=CC=C2)C3=CC=CC=C3)CCN1C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1C[N+](=C(C#CC2=CC=CC=C2)C3=CC=CC=C3)CCN1C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H22F3N2/c27-26(28,29)23-12-7-13-24(20-23)30-16-18-31(19-17-30)25(22-10-5-2-6-11-22)15-14-21-8-3-1-4-9-21/h1-13,20H,16-19H2/q+1