methyl 4-(6-aminopurin-9-yl)cyclohexene-1-carboxylate

Systemtic Name: methyl 4-(6-aminopurin-9-yl)cyclohexene-1-carboxylate Openeye Name: methyl 4-(6-aminopurin-9-yl)cyclohexene-1-carboxylate CAS Name: 4-(6-aminopurin-9-yl)-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl 4-(6-aminopurin-9-yl)cyclohexene-1-carboxylate Traditional Name: 4-adenin-9-ylcyclohexene-1-carboxylic acid methyl ester Formula: C13H15N5O2 MolecularWeight: 273.2905

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC(CC1)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

COC(=O)C1=CCC(CC1)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C13H15N5O2/c1-20-13(19)8-2-4-9(5-3-8)18-7-17-10-11(14)15-6-16-12(10)18/h2,6-7,9H,3-5H2,1H3,(H2,14,15,16)