[4-[2,6-bis(azanyl)purin-9-yl]-1,3-dioxolan-2-yl]methyl 2-methylpropanoate

Systemtic Name: [4-[2,6-bis(azanyl)purin-9-yl]-1,3-dioxolan-2-yl]methyl 2-methylpropanoate Openeye Name: [4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-(2,6-diamino-9-purinyl)-1,3-dioxolan-2-yl]methyl ester IUPAC Name: [4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methyl ester Formula: C13H18N6O4 MolecularWeight: 322.31982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC1OCC(O1)N2C=NC3=C2N=C(N=C3N)N

Isomeric SMILES

CC(C)C(=O)OCC1OCC(O1)N2C=NC3=C2N=C(N=C3N)N

InChI

InChI=1S/C13H18N6O4/c1-6(2)12(20)22-4-8-21-3-7(23-8)19-5-16-9-10(14)17-13(15)18-11(9)19/h5-8H,3-4H2,1-2H3,(H4,14,15,17,18)