dimethyl 7-oxidanylidene-1H-pyrido[2,1-f]purine-8,10-dicarboxylate

Systemtic Name: dimethyl 7-oxidanylidene-1H-pyrido[2,1-f]purine-8,10-dicarboxylate Openeye Name: dimethyl 7-oxo-1H-pyrido[2,1-f]purine-8,10-dicarboxylate CAS Name: 7-oxo-1H-pyrido[2,1-f]purine-8,10-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-oxo-1H-pyrido[2,1-f]purine-8,10-dicarboxylate Traditional Name: 7-keto-1H-pyrido[2,1-f]purine-8,10-dicarboxylic acid dimethyl ester Formula: C13H10N4O5 MolecularWeight: 302.2423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C3=C(N=CN3)N=CN2C1=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=C2C3=C(N=CN3)N=CN2C1=O)C(=O)OC

InChI

InChI=1S/C13H10N4O5/c1-21-12(19)6-3-7(13(20)22-2)11(18)17-5-16-10-8(9(6)17)14-4-15-10/h3-5H,1-2H3,(H,14,15)