tert-butyl 2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloranyl-purine-9-carboxylate

Systemtic Name: tert-butyl 2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloranyl-purine-9-carboxylate Openeye Name: tert-butyl 2-[bis(tert-butoxycarbonyl)amino]-6-chloro-purine-9-carboxylate CAS Name: 2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-chloro-9-purinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropurine-9-carboxylate Traditional Name: 2-[bis(tert-butoxycarbonyl)amino]-6-chloro-purine-9-carboxylic acid tert-butyl ester Formula: C20H28ClN5O6 MolecularWeight: 469.91922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=NC2=C1N=C(N=C2Cl)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=NC2=C1N=C(N=C2Cl)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H28ClN5O6/c1-18(2,3)30-15(27)25-10-22-11-12(21)23-14(24-13(11)25)26(16(28)31-19(4,5)6)17(29)32-20(7,8)9/h10H,1-9H3