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

Systemtic Name: ethyl 2-[1-(3,4-dimethylphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-[1-(3,4-dimethylphenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]acetate CAS Name: 2-[1-(3,4-dimethylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(3,4-dimethylphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]acetate Traditional Name: 2-[1-(3,4-dimethylphenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]acetic acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=NC2=C(C1=O)C=NN2C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)CN1C=NC2=C(C1=O)C=NN2C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C17H18N4O3/c1-4-24-15(22)9-20-10-18-16-14(17(20)23)8-19-21(16)13-6-5-11(2)12(3)7-13/h5-8,10H,4,9H2,1-3H3