methyl 4-(6-azidopurin-9-yl)cyclopent-2-ene-1-carboxylate

Systemtic Name: methyl 4-(6-azidopurin-9-yl)cyclopent-2-ene-1-carboxylate Openeye Name: methyl 4-(6-azidopurin-9-yl)cyclopent-2-ene-1-carboxylate CAS Name: 4-(6-azido-9-purinyl)-1-cyclopent-2-enecarboxylic acid methyl ester IUPAC Name: methyl 4-(6-azidopurin-9-yl)cyclopent-2-ene-1-carboxylate Traditional Name: 4-(6-azidopurin-9-yl)cyclopent-2-ene-1-carboxylic acid methyl ester Formula: C12H11N7O2 MolecularWeight: 285.26144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C=C1)N2C=NC3=C(N=CN=C32)N=[N+]=[N-]

Isomeric SMILES

COC(=O)C1CC(C=C1)N2C=NC3=C(N=CN=C32)N=[N+]=[N-]

InChI

InChI=1S/C12H11N7O2/c1-21-12(20)7-2-3-8(4-7)19-6-16-9-10(17-18-13)14-5-15-11(9)19/h2-3,5-8H,4H2,1H3