2-[[2-acetamido-6-(diphenylcarbamoyloxy)purin-9-yl]methoxy]ethyl ethanoate

Systemtic Name: 2-[[2-acetamido-6-(diphenylcarbamoyloxy)purin-9-yl]methoxy]ethyl ethanoate Openeye Name: 2-[[2-acetamido-6-(diphenylcarbamoyloxy)purin-9-yl]methoxy]ethyl acetate CAS Name: acetic acid 2-[[2-acetamido-6-[oxo-(N-phenylanilino)methoxy]-9-purinyl]methoxy]ethyl ester IUPAC Name: 2-[[2-acetamido-6-(diphenylcarbamoyloxy)purin-9-yl]methoxy]ethyl acetate Traditional Name: acetic acid 2-[[2-acetamido-6-(diphenylcarbamoyloxy)purin-9-yl]methoxy]ethyl ester Formula: C25H24N6O6 MolecularWeight: 504.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2COCCOC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2COCCOC(=O)C

InChI

InChI=1S/C25H24N6O6/c1-17(32)27-24-28-22-21(26-15-30(22)16-35-13-14-36-18(2)33)23(29-24)37-25(34)31(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,15H,13-14,16H2,1-2H3,(H,27,28,29,32)