2-chloranyl-8-[4-(trifluoromethyl)phenyl]-7H-purine

Systemtic Name: 2-chloranyl-8-[4-(trifluoromethyl)phenyl]-7H-purine Openeye Name: 2-chloro-8-[4-(trifluoromethyl)phenyl]-7H-purine CAS Name: 2-chloro-8-[4-(trifluoromethyl)phenyl]-7H-purine IUPAC Name: 2-chloro-8-[4-(trifluoromethyl)phenyl]-7H-purine Traditional Name: 2-chloro-8-[4-(trifluoromethyl)phenyl]-7H-purine Formula: C12H6ClF3N4 MolecularWeight: 298.65105

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=NC(=NC=C3N2)Cl)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=NC(=NC=C3N2)Cl)C(F)(F)F

InChI

InChI=1S/C12H6ClF3N4/c13-11-17-5-8-10(20-11)19-9(18-8)6-1-3-7(4-2-6)12(14,15)16/h1-5H,(H,17,18,19,20)