2-azanyl-9-[(Z)-1,3,3,3-tetrakis(fluoranyl)prop-1-enyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(Z)-1,3,3,3-tetrakis(fluoranyl)prop-1-enyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]-3H-purin-6-one CAS Name: 2-amino-9-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]-3H-purin-6-one Formula: C8H5F4N5O MolecularWeight: 263.151813

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C(=CC(F)(F)F)F)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1/C(=C/C(F)(F)F)/F)NC(=NC2=O)N

InChI

InChI=1S/C8H5F4N5O/c9-3(1-8(10,11)12)17-2-14-4-5(17)15-7(13)16-6(4)18/h1-2H,(H3,13,15,16,18)/b3-1+