3-chloranyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzenecarbonitrile Openeye Name: 3-chloro-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzonitrile CAS Name: 3-chloro-4-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]benzonitrile IUPAC Name: 3-chloro-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzonitrile Traditional Name: 3-chloro-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzonitrile Formula: C13H8ClN5O MolecularWeight: 285.68852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)OC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)OC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C13H8ClN5O/c1-19-12-9(6-18-19)13(17-7-16-12)20-11-3-2-8(5-15)4-10(11)14/h2-4,6-7H,1H3