tert-butyl 4-(9-methyl-2-propan-2-yloxy-6H-purin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(9-methyl-2-propan-2-yloxy-6H-purin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-isopropoxy-9-methyl-6H-purin-1-yl)piperazine-1-carboxylate CAS Name: 4-(9-methyl-2-propan-2-yloxy-6H-purin-1-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(9-methyl-2-propan-2-yloxy-6H-purin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(2-isopropoxy-9-methyl-6H-purin-1-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H30N6O3 MolecularWeight: 378.4692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C

Isomeric SMILES

CC(C)OC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C

InChI

InChI=1S/C18H30N6O3/c1-13(2)26-16-20-15-14(19-12-21(15)6)11-24(16)23-9-7-22(8-10-23)17(25)27-18(3,4)5/h12-13H,7-11H2,1-6H3