ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-6-oxidanylidene-3H-purin-9-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-6-oxidanylidene-3H-purin-9-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(tert-butoxycarbonylamino)ethylamino]-6-oxo-3H-purin-9-yl]acetate CAS Name: 2-[2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]-6-oxo-3H-purin-9-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-6-oxo-3H-purin-9-yl]acetate Traditional Name: 2-[2-[2-(tert-butoxycarbonylamino)ethylamino]-6-keto-3H-purin-9-yl]acetic acid ethyl ester Formula: C16H24N6O5 MolecularWeight: 380.39896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=NC2=C1NC(=NC2=O)NCCNC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN1C=NC2=C1NC(=NC2=O)NCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C16H24N6O5/c1-5-26-10(23)8-22-9-19-11-12(22)20-14(21-13(11)24)17-6-7-18-15(25)27-16(2,3)4/h9H,5-8H2,1-4H3,(H,18,25)(H2,17,20,21,24)