methyl 2-[2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanoylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanoylamino]-2-methyl-propanoate Openeye Name: methyl 2-[[2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)acetyl]amino]-2-methyl-propanoate CAS Name: 2-[[2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-1-oxoethyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(3,7-dimethyl-2,6-dioxopurin-1-yl)acetyl]amino]-2-methylpropanoate Traditional Name: 2-[[2-(2,6-diketo-3,7-dimethyl-purin-1-yl)acetyl]amino]-2-methyl-propionic acid methyl ester Formula: C14H19N5O5 MolecularWeight: 337.33116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)CN1C(=O)C2=C(N=CN2C)N(C1=O)C

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)CN1C(=O)C2=C(N=CN2C)N(C1=O)C

InChI

InChI=1S/C14H19N5O5/c1-14(2,12(22)24-5)16-8(20)6-19-11(21)9-10(15-7-17(9)3)18(4)13(19)23/h7H,6H2,1-5H3,(H,16,20)