4-[[(8-fluoranyl-7H-purin-6-yl)-methyl-amino]methyl]benzene-1,2-diol

Systemtic Name: 4-[[(8-fluoranyl-7H-purin-6-yl)-methyl-amino]methyl]benzene-1,2-diol Openeye Name: 4-[[(8-fluoro-7H-purin-6-yl)-methyl-amino]methyl]benzene-1,2-diol CAS Name: 4-[[(8-fluoro-7H-purin-6-yl)-methylamino]methyl]benzene-1,2-diol IUPAC Name: 4-[[(8-fluoro-7H-purin-6-yl)-methylamino]methyl]benzene-1,2-diol Traditional Name: 4-[[(8-fluoro-7H-purin-6-yl)-methyl-amino]methyl]pyrocatechol Formula: C13H12FN5O2 MolecularWeight: 289.265083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)O)O)C2=NC=NC3=C2NC(=N3)F

Isomeric SMILES

CN(CC1=CC(=C(C=C1)O)O)C2=NC=NC3=C2NC(=N3)F

InChI

InChI=1S/C13H12FN5O2/c1-19(5-7-2-3-8(20)9(21)4-7)12-10-11(15-6-16-12)18-13(14)17-10/h2-4,6,20-21H,5H2,1H3,(H,15,16,17,18)