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

Systemtic Name: 2-[4-methyl-1,3-bis(oxidanylidene)-6-phenyl-7,8-dihydropurino[7,8-a]imidazol-2-yl]ethanoate Openeye Name: 2-(4-methyl-1,3-dioxo-6-phenyl-7,8-dihydropurino[7,8-a]imidazol-2-yl)acetate CAS Name: 2-(4-methyl-1,3-dioxo-6-phenyl-7,8-dihydropurino[7,8-a]imidazol-2-yl)acetate IUPAC Name: 2-(4-methyl-1,3-dioxo-6-phenyl-7,8-dihydropurino[7,8-a]imidazol-2-yl)acetate Traditional Name: 2-(1,3-diketo-4-methyl-6-phenyl-7,8-dihydropurin[7,8-a]imidazol-2-yl)acetate Formula: C16H14N5O4- MolecularWeight: 340.31346

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C16H15N5O4/c1-18-13-12(14(24)21(16(18)25)9-11(22)23)20-8-7-19(15(20)17-13)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,22,23)/p-1