[1-methyl-3-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-7-yl]methyl (phenylmethyl) carbonate

Systemtic Name: [1-methyl-3-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-7-yl]methyl (phenylmethyl) carbonate Openeye Name: benzyl (3-isobutyl-1-methyl-2,6-dioxo-purin-7-yl)methyl carbonate CAS Name: carbonic acid [1-methyl-3-(2-methylpropyl)-2,6-dioxo-7-purinyl]methyl (phenylmethyl) ester IUPAC Name: benzyl [1-methyl-3-(2-methylpropyl)-2,6-dioxopurin-7-yl]methyl carbonate Traditional Name: carbonic acid benzyl (3-isobutyl-2,6-diketo-1-methyl-purin-7-yl)methyl ester Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)N(C1=O)C)N(C=N2)COC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C2=C(C(=O)N(C1=O)C)N(C=N2)COC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22N4O5/c1-13(2)9-23-16-15(17(24)21(3)18(23)25)22(11-20-16)12-28-19(26)27-10-14-7-5-4-6-8-14/h4-8,11,13H,9-10,12H2,1-3H3