[2-[(2-azanyl-6-phenylmethoxy-purin-9-yl)methyl]-4,4-diethoxy-butyl] ethanoate

Systemtic Name: [2-[(2-azanyl-6-phenylmethoxy-purin-9-yl)methyl]-4,4-diethoxy-butyl] ethanoate Openeye Name: [2-[(2-amino-6-benzyloxy-purin-9-yl)methyl]-4,4-diethoxy-butyl] acetate CAS Name: acetic acid [2-[(2-amino-6-phenylmethoxy-9-purinyl)methyl]-4,4-diethoxybutyl] ester IUPAC Name: [2-[(2-amino-6-phenylmethoxypurin-9-yl)methyl]-4,4-diethoxybutyl] acetate Traditional Name: acetic acid [2-[(2-amino-6-benzoxy-purin-9-yl)methyl]-4,4-diethoxy-butyl] ester Formula: C23H31N5O5 MolecularWeight: 457.52274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(CN1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N)COC(=O)C)OCC

Isomeric SMILES

CCOC(CC(CN1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N)COC(=O)C)OCC

InChI

InChI=1S/C23H31N5O5/c1-4-30-19(31-5-2)11-18(14-32-16(3)29)12-28-15-25-20-21(28)26-23(24)27-22(20)33-13-17-9-7-6-8-10-17/h6-10,15,18-19H,4-5,11-14H2,1-3H3,(H2,24,26,27)