[2-(acetyloxymethyl)-4-(2-azanyl-6-ethyl-purin-9-yl)butyl] ethanoate

Systemtic Name: [2-(acetyloxymethyl)-4-(2-azanyl-6-ethyl-purin-9-yl)butyl] ethanoate Openeye Name: [2-(acetoxymethyl)-4-(2-amino-6-ethyl-purin-9-yl)butyl] acetate CAS Name: acetic acid [2-(acetyloxymethyl)-4-(2-amino-6-ethyl-9-purinyl)butyl] ester IUPAC Name: [2-(acetyloxymethyl)-4-(2-amino-6-ethylpurin-9-yl)butyl] acetate Traditional Name: acetic acid [2-(acetoxymethyl)-4-(2-amino-6-ethyl-purin-9-yl)butyl] ester Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=N1)N)N(C=N2)CCC(COC(=O)C)COC(=O)C

Isomeric SMILES

CCC1=C2C(=NC(=N1)N)N(C=N2)CCC(COC(=O)C)COC(=O)C

InChI

InChI=1S/C16H23N5O4/c1-4-13-14-15(20-16(17)19-13)21(9-18-14)6-5-12(7-24-10(2)22)8-25-11(3)23/h9,12H,4-8H2,1-3H3,(H2,17,19,20)