4-(6-aminopurin-9-yl)cyclohex-2-en-1-one

Systemtic Name: 4-(6-aminopurin-9-yl)cyclohex-2-en-1-one Openeye Name: 4-(6-aminopurin-9-yl)cyclohex-2-en-1-one CAS Name: 4-(6-aminopurin-9-yl)-1-cyclohex-2-enone IUPAC Name: 4-(6-aminopurin-9-yl)cyclohex-2-en-1-one Traditional Name: 4-adenin-9-ylcyclohex-2-en-1-one Formula: C11H11N5O MolecularWeight: 229.23794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C=CC1N2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1CC(=O)C=CC1N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C11H11N5O/c12-10-9-11(14-5-13-10)16(6-15-9)7-1-3-8(17)4-2-7/h1,3,5-7H,2,4H2,(H2,12,13,14)