3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-amine

Systemtic Name: 3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-amine Openeye Name: 3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-amine CAS Name: 3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-amine IUPAC Name: 3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-amine Traditional Name: [3-(3-bromophenyl)-3-(trifluoromethyl)-4H-isoquinolin-1-yl]amine Formula: C16H12BrF3N2 MolecularWeight: 369.17909

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrF3N2/c17-12-6-3-5-11(8-12)15(16(18,19)20)9-10-4-1-2-7-13(10)14(21)22-15/h1-8H,9H2,(H2,21,22)