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

Systemtic Name: [1-methyl-3-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-7-yl]methyl 2-formamidoethanoate Openeye Name: (3-isobutyl-1-methyl-2,6-dioxo-purin-7-yl)methyl 2-formamidoacetate CAS Name: 2-formamidoacetic acid [1-methyl-3-(2-methylpropyl)-2,6-dioxo-7-purinyl]methyl ester IUPAC Name: [1-methyl-3-(2-methylpropyl)-2,6-dioxopurin-7-yl]methyl 2-formamidoacetate Traditional Name: 2-formamidoacetic acid (3-isobutyl-2,6-diketo-1-methyl-purin-7-yl)methyl ester Formula: C14H19N5O5 MolecularWeight: 337.33116

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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)CNC=O

Isomeric SMILES

CC(C)CN1C2=C(C(=O)N(C1=O)C)N(C=N2)COC(=O)CNC=O

InChI

InChI=1S/C14H19N5O5/c1-9(2)5-19-12-11(13(22)17(3)14(19)23)18(6-16-12)8-24-10(21)4-15-7-20/h6-7,9H,4-5,8H2,1-3H3,(H,15,20)