tert-butyl [2-[(8-butyl-2-methoxy-purin-9-yl)methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[(8-butyl-2-methoxy-purin-9-yl)methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[(8-butyl-2-methoxy-purin-9-yl)methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[(8-butyl-2-methoxy-9-purinyl)methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[(8-butyl-2-methoxypurin-9-yl)methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[(8-butyl-2-methoxy-purin-9-yl)methyl]-6-phenyl-phenyl] ester Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CN=C(N=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)OC

Isomeric SMILES

CCCCC1=NC2=CN=C(N=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)OC

InChI

InChI=1S/C28H32N4O4/c1-6-7-16-23-30-22-17-29-26(34-5)31-25(22)32(23)18-20-14-11-15-21(19-12-9-8-10-13-19)24(20)35-27(33)36-28(2,3)4/h8-15,17H,6-7,16,18H2,1-5H3