[1-(2-azanyl-6-phenylmethoxy-purin-9-yl)cyclobutyl]methyl benzoate

Systemtic Name: [1-(2-azanyl-6-phenylmethoxy-purin-9-yl)cyclobutyl]methyl benzoate Openeye Name: [1-(2-amino-6-benzyloxy-purin-9-yl)cyclobutyl]methyl benzoate CAS Name: benzoic acid [1-(2-amino-6-phenylmethoxy-9-purinyl)cyclobutyl]methyl ester IUPAC Name: [1-(2-amino-6-phenylmethoxypurin-9-yl)cyclobutyl]methyl benzoate Traditional Name: benzoic acid [1-(2-amino-6-benzoxy-purin-9-yl)cyclobutyl]methyl ester Formula: C24H23N5O3 MolecularWeight: 429.47112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(COC(=O)C2=CC=CC=C2)N3C=NC4=C3N=C(N=C4OCC5=CC=CC=C5)N

Isomeric SMILES

C1CC(C1)(COC(=O)C2=CC=CC=C2)N3C=NC4=C3N=C(N=C4OCC5=CC=CC=C5)N

InChI

InChI=1S/C24H23N5O3/c25-23-27-20-19(21(28-23)31-14-17-8-3-1-4-9-17)26-16-29(20)24(12-7-13-24)15-32-22(30)18-10-5-2-6-11-18/h1-6,8-11,16H,7,12-15H2,(H2,25,27,28)