ethyl 4-[[7-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[7-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[7-(2-ethoxy-2-oxo-ethyl)-1,3-dimethyl-2,6-dioxo-purin-8-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[7-(2-ethoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-8-purinyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[7-(2-ethoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxopurin-8-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[7-(2-ethoxy-2-keto-ethyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H28N6O6 MolecularWeight: 436.46222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C19H28N6O6/c1-5-30-14(26)12-25-13(11-23-7-9-24(10-8-23)19(29)31-6-2)20-16-15(25)17(27)22(4)18(28)21(16)3/h5-12H2,1-4H3