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

Systemtic Name: 4-[1-(2-ethoxy-2-oxidanylidene-ethyl)-3-methyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]piperazine-1-carboxylic acid Openeye Name: 4-[1-(2-ethoxy-2-oxo-ethyl)-3-methyl-2,6-dioxo-7H-purin-8-yl]piperazine-1-carboxylic acid CAS Name: 4-[1-(2-ethoxy-2-oxoethyl)-3-methyl-2,6-dioxo-7H-purin-8-yl]-1-piperazinecarboxylic acid IUPAC Name: 4-[1-(2-ethoxy-2-oxoethyl)-3-methyl-2,6-dioxo-7H-purin-8-yl]piperazine-1-carboxylic acid Traditional Name: 4-[1-(2-ethoxy-2-keto-ethyl)-2,6-diketo-3-methyl-7H-purin-8-yl]piperazine-1-carboxylic acid Formula: C15H20N6O6 MolecularWeight: 380.3559

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=C(N=C(N2)N3CCN(CC3)C(=O)O)N(C1=O)C

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=C(N=C(N2)N3CCN(CC3)C(=O)O)N(C1=O)C

InChI

InChI=1S/C15H20N6O6/c1-3-27-9(22)8-21-12(23)10-11(18(2)14(21)24)17-13(16-10)19-4-6-20(7-5-19)15(25)26/h3-8H2,1-2H3,(H,16,17)(H,25,26)