tert-butyl 4-(2-chloranyl-6-morpholin-4-yl-purin-9-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-chloranyl-6-morpholin-4-yl-purin-9-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(2-chloro-6-morpholino-purin-9-yl)piperidine-1-carboxylate CAS Name: 4-[2-chloro-6-(4-morpholinyl)-9-purinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-chloro-6-morpholin-4-ylpurin-9-yl)piperidine-1-carboxylate Traditional Name: 4-(2-chloro-6-morpholino-purin-9-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H27ClN6O3 MolecularWeight: 422.90908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC3=C2N=C(N=C3N4CCOCC4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC3=C2N=C(N=C3N4CCOCC4)Cl

InChI

InChI=1S/C19H27ClN6O3/c1-19(2,3)29-18(27)25-6-4-13(5-7-25)26-12-21-14-15(22-17(20)23-16(14)26)24-8-10-28-11-9-24/h12-13H,4-11H2,1-3H3