4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxymethyl]benzenecarbonitrile Openeye Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxymethyl]benzonitrile CAS Name: 4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxymethyl]benzonitrile IUPAC Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxymethyl]benzonitrile Traditional Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxymethyl]benzonitrile Formula: C19H13N5O MolecularWeight: 327.33942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C19H13N5O/c20-10-14-6-8-15(9-7-14)12-25-19-17-11-23-24(18(17)21-13-22-19)16-4-2-1-3-5-16/h1-9,11,13H,12H2