2-(2-propoxyphenyl)-8-(trifluoromethyl)purin-6-one

Systemtic Name: 2-(2-propoxyphenyl)-8-(trifluoromethyl)purin-6-one Openeye Name: 2-(2-propoxyphenyl)-8-(trifluoromethyl)purin-6-one CAS Name: 2-(2-propoxyphenyl)-8-(trifluoromethyl)-6-purinone IUPAC Name: 2-(2-propoxyphenyl)-8-(trifluoromethyl)purin-6-one Traditional Name: 2-(2-propoxyphenyl)-8-(trifluoromethyl)purin-6-one Formula: C15H11F3N4O2 MolecularWeight: 336.26865

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=NC(=NC3=N2)C(F)(F)F

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=NC(=NC3=N2)C(F)(F)F

InChI

InChI=1S/C15H11F3N4O2/c1-2-7-24-9-6-4-3-5-8(9)11-20-12-10(13(23)21-11)19-14(22-12)15(16,17)18/h3-6H,2,7H2,1H3