3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-amine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-amine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-amine; 2,2,2-trifluoroacetic acid CAS Name: 3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-amine; 2,2,2-trifluoroacetic acid IUPAC Name: 3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-amine; 2,2,2-trifluoroacetic acid Traditional Name: [3-(3-bromophenyl)-3-phenyl-4H-isoquinolin-1-yl]amine; 2,2,2-trifluoroacetic acid Formula: C23H18BrF3N2O2 MolecularWeight: 491.30043

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC1(C3=CC=CC=C3)C4=CC(=CC=C4)Br)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1C2=CC=CC=C2C(=NC1(C3=CC=CC=C3)C4=CC(=CC=C4)Br)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C21H17BrN2.C2HF3O2/c22-18-11-6-10-17(13-18)21(16-8-2-1-3-9-16)14-15-7-4-5-12-19(15)20(23)24-21;3-2(4,5)1(6)7/h1-13H,14H2,(H2,23,24);(H,6,7)