ethyl 2-(6-chloranyl-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoate

Systemtic Name: ethyl 2-(6-chloranyl-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoate Openeye Name: ethyl 2-(6-chloro-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)acetate CAS Name: 2-(6-chloro-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(6-chloro-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)acetate Traditional Name: 2-(6-chloro-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-5-yl)acetic acid ethyl ester Formula: C15H15ClN4O2 MolecularWeight: 318.7582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CC2=C(N=C1Cl)N(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1CC2=C(N=C1Cl)N(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C15H15ClN4O2/c1-2-22-13(21)10-19-9-11-8-17-20(14(11)18-15(19)16)12-6-4-3-5-7-12/h3-8H,2,9-10H2,1H3