4-[(1-oxidanyl-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzenecarbonitrile

Systemtic Name: 4-[(1-oxidanyl-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzenecarbonitrile Openeye Name: 4-[(1-hydroxy-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzonitrile CAS Name: 4-[(1-hydroxy-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzonitrile IUPAC Name: 4-[(1-hydroxy-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzonitrile Traditional Name: 4-[(1-hydroxy-3-phenyl-3H-2,1-benzoxaborol-5-yl)oxy]benzonitrile Formula: C20H14BNO3 MolecularWeight: 327.14106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=C(C=C2)OC3=CC=C(C=C3)C#N)C(O1)C4=CC=CC=C4)O

Isomeric SMILES

B1(C2=C(C=C(C=C2)OC3=CC=C(C=C3)C#N)C(O1)C4=CC=CC=C4)O

InChI

InChI=1S/C20H14BNO3/c22-13-14-6-8-16(9-7-14)24-17-10-11-19-18(12-17)20(25-21(19)23)15-4-2-1-3-5-15/h1-12,20,23H