6-(4-phenylbut-1-ynyl)naphthalene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 6-(4-phenylbut-1-ynyl)naphthalene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 6-(4-phenylbut-1-ynyl)naphthalene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 6-(4-phenylbut-1-ynyl)-2-naphthalenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 6-(4-phenylbut-1-ynyl)naphthalene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 6-(4-phenylbut-1-ynyl)-2-naphthamidine; 2,2,2-trifluoroacetic acid Formula: C23H19F3N2O2 MolecularWeight: 412.40437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC#CC2=CC3=C(C=C2)C=C(C=C3)C(=N)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)CCC#CC2=CC3=C(C=C2)C=C(C=C3)C(=N)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C21H18N2.C2HF3O2/c22-21(23)20-13-12-18-14-17(10-11-19(18)15-20)9-5-4-8-16-6-2-1-3-7-16;3-2(4,5)1(6)7/h1-3,6-7,10-15H,4,8H2,(H3,22,23);(H,6,7)