methyl 2-chloranyl-7H-purine-8-carboxylate

Systemtic Name: methyl 2-chloranyl-7H-purine-8-carboxylate Openeye Name: methyl 2-chloro-7H-purine-8-carboxylate CAS Name: 2-chloro-7H-purine-8-carboxylic acid methyl ester IUPAC Name: methyl 2-chloro-7H-purine-8-carboxylate Traditional Name: 2-chloro-7H-purine-8-carboxylic acid methyl ester Formula: C7H5ClN4O2 MolecularWeight: 212.5932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=NC(=NC=C2N1)Cl

Isomeric SMILES

COC(=O)C1=NC2=NC(=NC=C2N1)Cl

InChI

InChI=1S/C7H5ClN4O2/c1-14-6(13)5-10-3-2-9-7(8)12-4(3)11-5/h2H,1H3,(H,9,10,11,12)