[3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-cyclopentylethanoate

Systemtic Name: [3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-cyclopentylethanoate Openeye Name: (3-butyl-2,6-dioxo-7-propyl-purin-8-yl)methyl 2-cyclopentylacetate CAS Name: 2-cyclopentylacetic acid (3-butyl-2,6-dioxo-7-propyl-8-purinyl)methyl ester IUPAC Name: (3-butyl-2,6-dioxo-7-propylpurin-8-yl)methyl 2-cyclopentylacetate Traditional Name: 2-cyclopentylacetic acid (3-butyl-2,6-diketo-7-propyl-purin-8-yl)methyl ester Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3CCCC3)CCC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3CCCC3)CCC

InChI

InChI=1S/C20H30N4O4/c1-3-5-11-24-18-17(19(26)22-20(24)27)23(10-4-2)15(21-18)13-28-16(25)12-14-8-6-7-9-14/h14H,3-13H2,1-2H3,(H,22,26,27)