ethyl 2-[1-(2,3-dimethylphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[1-(2,3-dimethylphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[1-(2,3-dimethylphenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-3-oxo-butanoate CAS Name: 2-[1-(2,3-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(2,3-dimethylphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-3-oxobutanoate Traditional Name: 2-[1-(2,3-dimethylphenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]-3-keto-butyric acid ethyl ester Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)N1C=NC2=C(C1=O)C=NN2C3=CC=CC(=C3C)C

Isomeric SMILES

CCOC(=O)C(C(=O)C)N1C=NC2=C(C1=O)C=NN2C3=CC=CC(=C3C)C

InChI

InChI=1S/C19H20N4O4/c1-5-27-19(26)16(13(4)24)22-10-20-17-14(18(22)25)9-21-23(17)15-8-6-7-11(2)12(15)3/h6-10,16H,5H2,1-4H3