[3-butyl-7-ethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)cyclopentane-1-carboxylate

Systemtic Name: [3-butyl-7-ethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)cyclopentane-1-carboxylate Openeye Name: (3-butyl-7-ethyl-2,6-dioxo-purin-8-yl)methyl 1-(2-morpholino-2-oxo-ethyl)cyclopentanecarboxylate CAS Name: 1-[2-(4-morpholinyl)-2-oxoethyl]-1-cyclopentanecarboxylic acid (3-butyl-7-ethyl-2,6-dioxo-8-purinyl)methyl ester IUPAC Name: (3-butyl-7-ethyl-2,6-dioxopurin-8-yl)methyl 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate Traditional Name: 1-(2-keto-2-morpholino-ethyl)cyclopentanecarboxylic acid (3-butyl-7-ethyl-2,6-diketo-purin-8-yl)methyl ester Formula: C24H35N5O6 MolecularWeight: 489.5646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)C3(CCCC3)CC(=O)N4CCOCC4)CC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)C3(CCCC3)CC(=O)N4CCOCC4)CC

InChI

InChI=1S/C24H35N5O6/c1-3-5-10-29-20-19(21(31)26-23(29)33)28(4-2)17(25-20)16-35-22(32)24(8-6-7-9-24)15-18(30)27-11-13-34-14-12-27/h3-16H2,1-2H3,(H,26,31,33)