2-chloranyl-5-[(7H-purin-6-ylamino)methyl]benzene-1,4-diol

Systemtic Name: 2-chloranyl-5-[(7H-purin-6-ylamino)methyl]benzene-1,4-diol Openeye Name: 2-chloro-5-[(7H-purin-6-ylamino)methyl]benzene-1,4-diol CAS Name: 2-chloro-5-[(7H-purin-6-ylamino)methyl]benzene-1,4-diol IUPAC Name: 2-chloro-5-[(7H-purin-6-ylamino)methyl]benzene-1,4-diol Traditional Name: 2-chloro-5-[(7H-purin-6-ylamino)methyl]hydroquinone Formula: C12H10ClN5O2 MolecularWeight: 291.6931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10ClN5O2/c13-7-2-8(19)6(1-9(7)20)3-14-11-10-12(16-4-15-10)18-5-17-11/h1-2,4-5,19-20H,3H2,(H2,14,15,16,17,18)