3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl cyclohexanecarboxylate

Systemtic Name: 3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl cyclohexanecarboxylate Openeye Name: 3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl ester IUPAC Name: 3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 3-(2,6-diketo-3,7-dimethyl-purin-1-yl)propyl ester Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)C3CCCCC3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)C3CCCCC3

InChI

InChI=1S/C17H24N4O4/c1-19-11-18-14-13(19)15(22)21(17(24)20(14)2)9-6-10-25-16(23)12-7-4-3-5-8-12/h11-12H,3-10H2,1-2H3