2-[6-(4-methoxyphenyl)-4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[7,8-a]imidazol-2-yl]ethanoate

Systemtic Name: 2-[6-(4-methoxyphenyl)-4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[7,8-a]imidazol-2-yl]ethanoate Openeye Name: 2-[6-(4-methoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate CAS Name: 2-[6-(4-methoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate IUPAC Name: 2-[6-(4-methoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate Traditional Name: 2-[1,3-diketo-6-(4-methoxyphenyl)-4-methyl-7,8-dihydropurin[7,8-a]imidazol-2-yl]acetate Formula: C17H16N5O5- MolecularWeight: 370.33944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC(=O)[O-])N3CCN(C3=N2)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC(=O)[O-])N3CCN(C3=N2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C17H17N5O5/c1-19-14-13(15(25)22(17(19)26)9-12(23)24)21-8-7-20(16(21)18-14)10-3-5-11(27-2)6-4-10/h3-6H,7-9H2,1-2H3,(H,23,24)/p-1