2-(2-azanyl-6-chloranyl-purin-9-yl)-4,5-bis(hydroxymethyl)cyclohexan-1-ol

Systemtic Name: 2-(2-azanyl-6-chloranyl-purin-9-yl)-4,5-bis(hydroxymethyl)cyclohexan-1-ol Openeye Name: 2-(2-amino-6-chloro-purin-9-yl)-4,5-bis(hydroxymethyl)cyclohexanol CAS Name: 2-(2-amino-6-chloro-9-purinyl)-4,5-bis(hydroxymethyl)-1-cyclohexanol IUPAC Name: 2-(2-amino-6-chloropurin-9-yl)-4,5-bis(hydroxymethyl)cyclohexan-1-ol Traditional Name: 2-(2-amino-6-chloro-purin-9-yl)-4,5-dimethylol-cyclohexanol Formula: C13H18ClN5O3 MolecularWeight: 327.76672

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CC(C1N2C=NC3=C2N=C(N=C3Cl)N)O)CO)CO

Isomeric SMILES

C1C(C(CC(C1N2C=NC3=C2N=C(N=C3Cl)N)O)CO)CO

InChI

InChI=1S/C13H18ClN5O3/c14-11-10-12(18-13(15)17-11)19(5-16-10)8-1-6(3-20)7(4-21)2-9(8)22/h5-9,20-22H,1-4H2,(H2,15,17,18)