ethyl 2-chloranyl-7H-purine-6-carboxylate

Systemtic Name: ethyl 2-chloranyl-7H-purine-6-carboxylate Openeye Name: ethyl 2-chloro-7H-purine-6-carboxylate CAS Name: 2-chloro-7H-purine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-7H-purine-6-carboxylate Traditional Name: 2-chloro-7H-purine-6-carboxylic acid ethyl ester Formula: C8H7ClN4O2 MolecularWeight: 226.61978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=NC(=N1)Cl)N=CN2

Isomeric SMILES

CCOC(=O)C1=C2C(=NC(=N1)Cl)N=CN2

InChI

InChI=1S/C8H7ClN4O2/c1-2-15-7(14)5-4-6(11-3-10-4)13-8(9)12-5/h3H,2H2,1H3,(H,10,11,12,13)