2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzenecarbonitrile

Systemtic Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzenecarbonitrile Openeye Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzonitrile CAS Name: 2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]benzonitrile IUPAC Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzonitrile Traditional Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzonitrile Formula: C18H11N5O MolecularWeight: 313.31284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC=CC=C4C#N

InChI

InChI=1S/C18H11N5O/c19-10-13-6-4-5-9-16(13)24-18-15-11-22-23(17(15)20-12-21-18)14-7-2-1-3-8-14/h1-9,11-12H