N-(10-prop-2-ynyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide; tris(fluoranyl)methanesulfonate

Systemtic Name: N-(10-prop-2-ynyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide; tris(fluoranyl)methanesulfonate Openeye Name: N-(10-prop-2-ynyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide; trifluoromethanesulfonate CAS Name: N-(10-prop-2-ynyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide; trifluoromethanesulfonate IUPAC Name: N-(10-prop-2-ynyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide; trifluoromethanesulfonate Traditional Name: N-(10-propargyl-1,2,3,4-tetrahydroacridin-10-ium-1-yl)benzamide triflate Formula: C24H21F3N2O4S MolecularWeight: 490.49475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC[N+]1=C2CCCC(C2=CC3=CC=CC=C31)NC(=O)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C#CC[N+]1=C2CCCC(C2=CC3=CC=CC=C31)NC(=O)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C23H20N2O.CHF3O3S/c1-2-15-25-21-13-7-6-11-18(21)16-19-20(12-8-14-22(19)25)24-23(26)17-9-4-3-5-10-17;2-1(3,4)8(5,6)7/h1,3-7,9-11,13,16,20H,8,12,14-15H2;(H,5,6,7)