8-(3-oxidanylidene-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(3-oxidanylidene-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(3-oxo-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(3-oxo-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(3-oxo-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(3-keto-4-azabicyclo[3.2.1]octan-6-yl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CC4CC3NC(=O)C4

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CC4CC3NC(=O)C4

InChI

InChI=1S/C18H25N5O3/c1-3-5-22-16-14(17(25)23(6-4-2)18(22)26)20-15(21-16)11-7-10-8-12(11)19-13(24)9-10/h10-12H,3-9H2,1-2H3,(H,19,24)(H,20,21)