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

Systemtic Name: 4-[[methyl(7H-purin-6-yl)amino]methyl]benzene-1,2-diol Openeye Name: 4-[[methyl(7H-purin-6-yl)amino]methyl]benzene-1,2-diol CAS Name: 4-[[methyl(7H-purin-6-yl)amino]methyl]benzene-1,2-diol IUPAC Name: 4-[[methyl(7H-purin-6-yl)amino]methyl]benzene-1,2-diol Traditional Name: 4-[[methyl(7H-purin-6-yl)amino]methyl]pyrocatechol Formula: C13H13N5O2 MolecularWeight: 271.27462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5O2/c1-18(5-8-2-3-9(19)10(20)4-8)13-11-12(15-6-14-11)16-7-17-13/h2-4,6-7,19-20H,5H2,1H3,(H,14,15,16,17)