2-[(1R,4R)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-fluoranyl-cyclopent-2-en-1-yl]ethylphosphonic acid

Systemtic Name: 2-[(1R,4R)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-fluoranyl-cyclopent-2-en-1-yl]ethylphosphonic acid Openeye Name: 2-[(1R,4R)-4-(2-amino-6-oxo-3H-purin-9-yl)-3-fluoro-cyclopent-2-en-1-yl]ethylphosphonic acid CAS Name: 2-[(1R,4R)-4-(2-amino-6-oxo-3H-purin-9-yl)-3-fluoro-1-cyclopent-2-enyl]ethylphosphonic acid IUPAC Name: 2-[(1R,4R)-4-(2-amino-6-oxo-3H-purin-9-yl)-3-fluorocyclopent-2-en-1-yl]ethylphosphonic acid Traditional Name: 2-[(1R,4R)-4-(2-amino-6-keto-3H-purin-9-yl)-3-fluoro-cyclopent-2-en-1-yl]ethylphosphonic acid Formula: C12H15FN5O4P MolecularWeight: 343.250764

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(C1N2C=NC3=C2NC(=NC3=O)N)F)CCP(=O)(O)O

Isomeric SMILES

C1[C@@H](C=C([C@@H]1N2C=NC3=C2NC(=NC3=O)N)F)CCP(=O)(O)O

InChI

InChI=1S/C12H15FN5O4P/c13-7-3-6(1-2-23(20,21)22)4-8(7)18-5-15-9-10(18)16-12(14)17-11(9)19/h3,5-6,8H,1-2,4H2,(H2,20,21,22)(H3,14,16,17,19)/t6-,8-/m1/s1