[8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: (8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)methyl ester IUPAC Name: (8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (8-cyclopentyl-2,6-diketo-1-propyl-7H-purin-3-yl)methyl ester Formula: C19H28N4O4 MolecularWeight: 376.45002

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)COC(=O)C(C)(C)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)COC(=O)C(C)(C)C

InChI

InChI=1S/C19H28N4O4/c1-5-10-22-16(24)13-15(21-14(20-13)12-8-6-7-9-12)23(18(22)26)11-27-17(25)19(2,3)4/h12H,5-11H2,1-4H3,(H,20,21)