4-fluoranyl-2-[(7H-purin-6-ylamino)methyl]benzene-1,3-diol

Systemtic Name: 4-fluoranyl-2-[(7H-purin-6-ylamino)methyl]benzene-1,3-diol Openeye Name: 4-fluoro-2-[(7H-purin-6-ylamino)methyl]benzene-1,3-diol CAS Name: 4-fluoro-2-[(7H-purin-6-ylamino)methyl]benzene-1,3-diol IUPAC Name: 4-fluoro-2-[(7H-purin-6-ylamino)methyl]benzene-1,3-diol Traditional Name: 4-fluoro-2-[(7H-purin-6-ylamino)methyl]resorcinol Formula: C12H10FN5O2 MolecularWeight: 275.238503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1O)CNC2=NC=NC3=C2NC=N3)O)F

Isomeric SMILES

C1=CC(=C(C(=C1O)CNC2=NC=NC3=C2NC=N3)O)F

InChI

InChI=1S/C12H10FN5O2/c13-7-1-2-8(19)6(10(7)20)3-14-11-9-12(16-4-15-9)18-5-17-11/h1-2,4-5,19-20H,3H2,(H2,14,15,16,17,18)